k050506koch/SPECTR
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The dataset generation failed because of a cast error
Error code: DatasetGenerationCastError
Exception: DatasetGenerationCastError
Message: An error occurred while generating the dataset
All the data files must have the same columns, but at some point there are 2 new columns ({'accession', 'instrument'})
This happened while the json dataset builder was generating data using
hf://datasets/k050506koch/SPECTR/mona_massbank_dataset.jsonl (at revision 26a08f9bf068591a63b1f57f078fc0611191c21d)
Please either edit the data files to have matching columns, or separate them into different configurations (see docs at https://hf.co/docs/hub/datasets-manual-configuration#multiple-configurations)
Traceback: Traceback (most recent call last):
File "/usr/local/lib/python3.12/site-packages/datasets/builder.py", line 1831, in _prepare_split_single
writer.write_table(table)
File "/usr/local/lib/python3.12/site-packages/datasets/arrow_writer.py", line 714, in write_table
pa_table = table_cast(pa_table, self._schema)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "/usr/local/lib/python3.12/site-packages/datasets/table.py", line 2272, in table_cast
return cast_table_to_schema(table, schema)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "/usr/local/lib/python3.12/site-packages/datasets/table.py", line 2218, in cast_table_to_schema
raise CastError(
datasets.table.CastError: Couldn't cast
source: string
name: string
formula: string
precursor_mz: double
adduct: string
ion_mode: null
collision_energy: null
peaks: list<item: struct<m/z: double, intensity: double>>
child 0, item: struct<m/z: double, intensity: double>
child 0, m/z: double
child 1, intensity: double
accession: string
instrument: null
to
{'source': Value('string'), 'name': Value('string'), 'formula': Value('string'), 'precursor_mz': Value('null'), 'adduct': Value('null'), 'ion_mode': Value('null'), 'collision_energy': Value('null'), 'peaks': List({'m/z': Value('float64'), 'intensity': Value('float64')})}
because column names don't match
During handling of the above exception, another exception occurred:
Traceback (most recent call last):
File "/src/services/worker/src/worker/job_runners/config/parquet_and_info.py", line 1455, in compute_config_parquet_and_info_response
parquet_operations = convert_to_parquet(builder)
^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "/src/services/worker/src/worker/job_runners/config/parquet_and_info.py", line 1054, in convert_to_parquet
builder.download_and_prepare(
File "/usr/local/lib/python3.12/site-packages/datasets/builder.py", line 894, in download_and_prepare
self._download_and_prepare(
File "/usr/local/lib/python3.12/site-packages/datasets/builder.py", line 970, in _download_and_prepare
self._prepare_split(split_generator, **prepare_split_kwargs)
File "/usr/local/lib/python3.12/site-packages/datasets/builder.py", line 1702, in _prepare_split
for job_id, done, content in self._prepare_split_single(
^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "/usr/local/lib/python3.12/site-packages/datasets/builder.py", line 1833, in _prepare_split_single
raise DatasetGenerationCastError.from_cast_error(
datasets.exceptions.DatasetGenerationCastError: An error occurred while generating the dataset
All the data files must have the same columns, but at some point there are 2 new columns ({'accession', 'instrument'})
This happened while the json dataset builder was generating data using
hf://datasets/k050506koch/SPECTR/mona_massbank_dataset.jsonl (at revision 26a08f9bf068591a63b1f57f078fc0611191c21d)
Please either edit the data files to have matching columns, or separate them into different configurations (see docs at https://hf.co/docs/hub/datasets-manual-configuration#multiple-configurations)Need help to make the dataset viewer work? Make sure to review how to configure the dataset viewer, and open a discussion for direct support.
source
string | name
string | formula
string | precursor_mz
null | adduct
null | ion_mode
null | collision_energy
null | peaks
list |
|---|---|---|---|---|---|---|---|
MassBank
|
N-[(1S)-1-(4-methoxy-6-oxopyran-2-yl)-2-phenylethyl]acetamide
|
C16H17NO4
| null | null | null | null |
[
{
"m/z": 91.0542,
"intensity": 2280306
},
{
"m/z": 125.0233,
"intensity": 9241725
},
{
"m/z": 154.0499,
"intensity": 755515.1875
},
{
"m/z": 155.0577,
"intensity": 3291112
},
{
"m/z": 185.0961,
"intensity": 3239590.5
},
{
"m/z": 200.107,
"intensity": 427603.8125
},
{
"m/z": 229.0859,
"intensity": 1328961.75
},
{
"m/z": 246.1125,
"intensity": 6794924.5
}
] |
MassBank
|
(2E,11S)-15,17-dihydroxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(14),2,15,17-tetraene-7,13-dione
|
C18H22O5
| null | null | null | null |
[
{
"m/z": 55.0185,
"intensity": 271807.28125
},
{
"m/z": 67.0542,
"intensity": 182020.6875
},
{
"m/z": 68.9971,
"intensity": 98984.078125
},
{
"m/z": 69.0699,
"intensity": 1981164.375
},
{
"m/z": 71.0491,
"intensity": 78678.328125
},
{
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"intensity": 150142.84375
},
{
"m/z": 81.0699,
"intensity": 132927
},
{
"m/z": 83.0491,
"intensity": 97777.1171875
},
{
"m/z": 85.0648,
"intensity": 290671.875
},
{
"m/z": 91.0542,
"intensity": 225303.671875
},
{
"m/z": 93.0699,
"intensity": 123108.1640625
},
{
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"intensity": 78146.9921875
},
{
"m/z": 95.0855,
"intensity": 136119.359375
},
{
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},
{
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"intensity": 188985.296875
},
{
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},
{
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},
{
"m/z": 117.0699,
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},
{
"m/z": 119.0855,
"intensity": 142407.28125
},
{
"m/z": 123.0441,
"intensity": 246228.546875
},
{
"m/z": 125.0961,
"intensity": 110869.4375
},
{
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},
{
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},
{
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},
{
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},
{
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},
{
"m/z": 147.0441,
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},
{
"m/z": 147.0804,
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},
{
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},
{
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},
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},
{
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},
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},
{
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},
{
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},
{
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},
{
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},
{
"m/z": 173.0597,
"intensity": 234703.125
},
{
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},
{
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},
{
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},
{
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},
{
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},
{
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},
{
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},
{
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"intensity": 153058.28125
},
{
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},
{
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},
{
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},
{
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},
{
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},
{
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},
{
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},
{
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},
{
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},
{
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},
{
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},
{
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},
{
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},
{
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},
{
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},
{
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},
{
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},
{
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},
{
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"intensity": 134109.09375
},
{
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"intensity": 212610.90625
},
{
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},
{
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},
{
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},
{
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},
{
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"intensity": 206529.171875
},
{
"m/z": 283.1329,
"intensity": 106777.59375
}
] |
MassBank
|
Isomarticin
|
C18H16O9
| null | null | null | null |
[
{
"m/z": 245.0444,
"intensity": 399611.59375
},
{
"m/z": 253.0495,
"intensity": 46770.91796875
},
{
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},
{
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},
{
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},
{
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},
{
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},
{
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},
{
"m/z": 303.0863,
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},
{
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"intensity": 809765
},
{
"m/z": 315.0863,
"intensity": 274680.21875
},
{
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},
{
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},
{
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},
{
"m/z": 359.0761,
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},
{
"m/z": 377.0867,
"intensity": 779417.25
}
] |
MassBank
|
[(6aR,9S,10R,10aR)-7,9-dimethyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-10-yl] acetate
|
C18H22N2O2
| null | null | null | null |
[
{
"m/z": 144.0808,
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},
{
"m/z": 168.0808,
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{
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},
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},
{
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},
{
"m/z": 299.1754,
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}
] |
MassBank
|
(3alpha,7beta,12epsilon)-7,15-Dihydroxy-8-oxo-12,13-epoxytrichothec-9-en-3-yl beta-D-glucopyranoside
|
C21H30O11
| null | null | null | null |
[
{
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},
{
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},
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{
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] |
MassBank
|
Enniatin B1
|
C34H59N3O9
| null | null | null | null |
[
{
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{
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{
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},
{
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}
] |
MassBank
|
(3beta,4alpha,7alpha)-3,7,15-Trihydroxy-8-oxo-12,13-epoxytrichothec-9-en-4-yl acetate
|
C17H22O8
| null | null | null | null |
[
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{
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{
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{
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{
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{
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{
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{
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{
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{
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{
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{
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{
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{
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},
{
"m/z": 277.107,
"intensity": 3070212
}
] |
MassBank
|
(7aR,10aS)-5-Methoxy-3,4,7a,9,10,10a-hexahydro-1H,12H-furo[3',2':4,5]furo[2,3-h]pyrano[3,4-c]chromene-1,12-dione
|
C17H14O7
| null | null | null | null |
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MassBank
|
12'-hydroxy-2'-(1-methylethyl)-5'alpha-(2-methylpropyl)ergotaman-3',6',18-trione
|
C32H41N5O5
| null | null | null | null |
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MassBank
|
(3E,5aS,10bR,11aS)-5a-Methyl-10b-(2-methyl-3-buten-2-yl)-3-{[1-(2-methyl-4-oxo-2-pentanyl)-1H-imidazol-4-yl]methylene}-6,10b,11,11a-tetrahydro-2H-pyrazino[1',2':1,5]pyrrolo[2,3-b]indole-1,4(3H,5aH)-di one
|
C28H33N5O3
| null | null | null | null |
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MassBank
|
(3S,6R,9S,12R,15S,18R)-3,9,15-tribenzyl-4,10,16-trimethyl-6,12,18-tri(propan-2-yl)-1,7,13-trioxa-4,10,16-triazacyclooctadecane-2,5,8,11,14,17-hexone
|
C45H57N3O9
| null | null | null | null |
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MassBank
|
3-monoacetyldeoxynivalenol
|
C17H22O7
| null | null | null | null |
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MassBank
|
Fumonisin B3
|
C34H59NO14
| null | null | null | null |
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MassBank
|
(7R,11S)-7,15,17-trihydroxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(14),15,17-trien-13-one
|
C18H26O5
| null | null | null | null |
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MassBank
|
Satratoxin F
|
C29H34O10
| null | null | null | null |
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MassBank
|
(3alpha,7beta,12epsilon)-7,15-Dihydroxy-8-oxo-12,13-epoxytrichothec-9-en-3-yl beta-D-glucopyranoside
|
C21H30O11
| null | null | null | null |
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MassBank
|
Koninginin A
|
C16H28O4
| null | null | null | null |
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MassBank
|
(3beta,4alpha,12R)-3-Hydroxy-12,13-epoxytrichothec-9-ene-4,15-diyl diacetate
|
C19H26O7
| null | null | null | null |
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MassBank
|
(3S,6R,9S,12R,15S,18R,21S,24R)-4,10,16,22-tetramethyl-3,9,15,21-tetrakis(2-methylpropyl)-6,12,18,24-tetra(propan-2-yl)-1,7,13,19-tetraoxa-4,10,16,22-tetrazacyclotetracosane-2,5,8,11,14,17,20,23-octone
|
C48H84N4O12
| null | null | null | null |
[
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MassBank
|
3-hydroxy-4-phenyl-1H-quinolin-2-one
|
C15H11NO2
| null | null | null | null |
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MassBank
|
Neosolaniol
|
C19H26O8
| null | null | null | null |
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MassBank
|
(1S,3R,3aS,4R,6R,8aR,9R)-Decahydro-1,5,5,8a-tetramethyl-1,4-methanoazulene-3,6,9-triol
|
C15H26O3
| null | null | null | null |
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MassBank
|
Enniatin B1
|
C34H59N3O9
| null | null | null | null |
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MassBank
|
Fumonisin B2
|
C34H59NO14
| null | null | null | null |
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MassBank
|
(1R,4S,5S,6R,9R)-5,6-dihydroxy-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undecan-3-one
|
C15H24O3
| null | null | null | null |
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MassBank
|
Chaetoglobosin A
|
C32H36N2O5
| null | null | null | null |
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MassBank
|
4-methyl-3'-phenylspiro[1H-1,4-benzodiazepine-3,2'-oxirane]-2,5-dione
|
C17H14N2O3
| null | null | null | null |
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MassBank
|
Enniatin A
|
C36H63N3O9
| null | null | null | null |
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MassBank
|
(2S)-6-[(3R,7R,8R,8aS)-3,4'-dihydroxy-4,4,7,8a-tetramethyl-6'-oxospiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-3,8-dihydrofuro[2,3-e]isoindole]-7'-yl]-2-[(2R,3S,7R,8R,8aS)-2,3,4'-trihydroxy-4,4,7,8a-tetramethyl-6'-oxospiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-3,8-dihydrofuro[2,3-e]isoindole]-7'-yl]hexanoic acid
|
C52H70N2O11
| null | null | null | null |
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MassBank
|
Ethyl 2-[(8-hydroxy-3-methyl-1-oxo-isochroman-7-carbonyl)amino]-3-phenyl-propanoate
|
C22H23NO6
| null | null | null | null |
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MassBank
|
Satratoxin G
|
C29H36O10
| null | null | null | null |
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MassBank
|
(1R,4S,5S,6R,9R)-5,6-dihydroxy-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undecan-3-one
|
C15H24O3
| null | null | null | null |
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MassBank
|
(5R,10S,10aR,14aS,15bS)-10,10a-dihydroxy-6-methoxy-2,2-dimethyl-5-(2-methylprop-1-en-1-yl)-1,10,10a,14,14a,15b-hexahydro-12H-3,4-dioxa-5a,11a,15a-triazacycloocta[1,2,3-lm]indeno[5,6-b]fluorene-11,15(2H,13H)-dione
|
C27H33N3O7
| null | null | null | null |
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MassBank
|
(3beta,4alpha,12R)-3-Hydroxy-12,13-epoxytrichothec-9-ene-4,15-diyl diacetate
|
C19H26O7
| null | null | null | null |
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MassBank
|
(1S,4S,7R,10S,13S)-7-(2-methylpropyl)-4,10-di(propan-2-yl)-15,16-dithia-3,6,9,12,18-pentazabicyclo[11.4.2]nonadecane-2,5,8,11,19-pentone
|
C22H37N5O5S2
| null | null | null | null |
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MassBank
|
12'-hydroxy-2'-methyl-5' alpha-(1-methylethyl)-ergotaman-3',6',18-trione
|
C29H35N5O5
| null | null | null | null |
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] |
MassBank
|
(2S)-4-acetyl-2-[(2S)-butan-2-yl]-3-hydroxy-1,2-dihydropyrrol-5-one
|
C10H15NO3
| null | null | null | null |
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MassBank
|
Isomarticin
|
C18H16O9
| null | null | null | null |
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MassBank
|
N-[(1S)-1-(4-methoxy-6-oxopyran-2-yl)-2-phenylethyl]acetamide
|
C16H17NO4
| null | null | null | null |
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MassBank
|
2,4-Dihydroxy-3,5-dimethyl-6-[(2S)-3-oxo-2-butanyl]benzaldehyde
|
C13H16O4
| null | null | null | null |
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MassBank
|
(8alpha)-5'alpha-Benzyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione
|
C35H39N5O5
| null | null | null | null |
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MassBank
|
(1S,7a'S,11a'R)-5',6',7a',10',11a'-Pentahydroxy-3'-methoxy-2,6,6-trimethyl-7',8',12'-trioxo-7',7a',8',11',11a',12'-hexahydro-1'H-spiro[cyclohex-2-ene-1,2'-cyclopenta[de]tetracene]-9'-carboxamide
|
C30H31NO10
| null | null | null | null |
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MassBank
|
3,7-dihydroxy-9-methoxy-1-methylbenzo[c]chromen-6-one
|
C15H12O5
| null | null | null | null |
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MassBank
|
(3S,6R,9S,12R,15S,18R,21S,24R)-4,10,16,22-tetramethyl-3,9,15,21-tetrakis(2-methylpropyl)-6,12,18,24-tetra(propan-2-yl)-1,7,13,19-tetraoxa-4,10,16,22-tetrazacyclotetracosane-2,5,8,11,14,17,20,23-octone
|
C48H84N4O12
| null | null | null | null |
[
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] |
MassBank
|
(1S,3R,3aS,4R,6R,8aR,9R)-Decahydro-1,5,5,8a-tetramethyl-1,4-methanoazulene-3,6,9-triol
|
C15H26O3
| null | null | null | null |
[
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MassBank
|
7,8-Dihydroxy calonectrin
|
C19H26O8
| null | null | null | null |
[
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MassBank
|
2,6-Epoxy-2H-naphth(2,3-d)oxocin-4-carboxylic acid, 1,4,5,6,7,12-hexahydro-8,11-dihydroxy-10-methoxy-2-methyl-7,12-dioxo-, (2alpha,4alpha,6alpha)-(+)-
|
C18H16O9
| null | null | null | null |
[
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MassBank
|
(2E,11S)-15,17-dihydroxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(14),2,15,17-tetraene-7,13-dione
|
C18H22O5
| null | null | null | null |
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MassBank
|
(3beta,4alpha,7alpha)-3,7,15-Trihydroxy-8-oxo-12,13-epoxytrichothec-9-en-4-yl acetate
|
C17H22O8
| null | null | null | null |
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] |
MassBank
|
Chaetoglobosin A
|
C32H36N2O5
| null | null | null | null |
[
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MassBank
|
2H-Pyrazino(1',2':1,5)pyrrolo(2,3-b)indole-1,4(3H,5aH)-dione, 10b-(1,1-dimethyl-2-propenyl)-6,10b,11,11a-tetrahydro-3-(1H-imidazol-4-ylmethylene)-
|
C22H23N5O2
| null | null | null | null |
[
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] |
MassBank
|
Satratoxin G
|
C29H36O10
| null | null | null | null |
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MassBank
|
(1S,4S,7R,10S,13S)-7-(2-methylpropyl)-4,10-di(propan-2-yl)-15,16-dithia-3,6,9,12,18-pentazabicyclo[11.4.2]nonadecane-2,5,8,11,19-pentone
|
C22H37N5O5S2
| null | null | null | null |
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MassBank
|
Fumonisin B2
|
C34H59NO14
| null | null | null | null |
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MassBank
|
Enniatin A1
|
C35H61N3O9
| null | null | null | null |
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MassBank
|
15-monoacetyldeoxynivalenol
|
C17H22O7
| null | null | null | null |
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MassBank
|
(3S,6S)-3-[(4-hydroxyphenyl)methyl]-3,6-bis(methylsulfanyl)piperazine-2,5-dione
|
C13H16N2O3S2
| null | null | null | null |
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MassBank
|
[4b(2Z,4E,6S,7S)]-4-(6,7-dihydroxy-2,4-octadienoate) 12,13-Epoxy-trichothec-9-ene-4,15-diol
|
C23H32O7
| null | null | null | null |
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MassBank
|
Oxaline
|
C24H25N5O4
| null | null | null | null |
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MassBank
|
12'-hydroxy-2'-(1-methyl)-5'alpha-(phenylmethyl)ergotaman-3',6',18-trione
|
C35H39N5O5
| null | null | null | null |
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MassBank
|
Fumonisin B3
|
C34H59NO14
| null | null | null | null |
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MassBank
|
NX2 toxin
|
C17H24O6
| null | null | null | null |
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MassBank
|
[(1S,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-7-methyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] (2S)-2-methylbutanoate
|
C23H34O5
| null | null | null | null |
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MassBank
|
3-[(3S,6R,9S,12S,15R,18S,21S,25R)-9-(carboxymethyl)-3,6,15,18-tetrakis(2-methylpropyl)-25-(10-methylundecyl)-2,5,8,11,14,17,20,23-octaoxo-12-propan-2-yl-1-oxa-4,7,10,13,16,19,22-heptazacyclopentacos-21-yl]propanoic acid
|
C53H93N7O13
| null | null | null | null |
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MassBank
|
12,13-Epoxy-3-alpha,7-alpha,15-trihydroxy-9-trichothecen-8-one
|
C15H20O6
| null | null | null | null |
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MassBank
|
(3E,7aS,12aR)-6-Hydroxy-3-(1H-imidazol-4-ylmethylene)-12-methoxy-7a-(2-methyl-3-buten-2-yl)-6,7,7a,12-tetrahydro-1H,5H-imidazo[1',2':1,2]pyrido[2,3-b]indole-2,5(3H)-dione
|
C23H25N5O4
| null | null | null | null |
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MassBank
|
(3S,8aS)-3-[[2-(3-methylbut-2-enyl)-1H-indol-3-yl]methyl]-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione
|
C21H25N3O2
| null | null | null | null |
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MassBank
|
3,15-Bis(acetyloxy)-12,13-epoxy-7-hydroxytrichothec-9-en-8-one (3alpha)-
|
C19H24O8
| null | null | null | null |
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] |
MassBank
|
Neosolaniol
|
C19H26O8
| null | null | null | null |
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MassBank
|
Fumiquinazoline F
|
C21H18N4O2
| null | null | null | null |
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MassBank
|
(1R,4S,5S,6R,9R)-5,6-dihydroxy-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undecan-3-one
|
C15H24O3
| null | null | null | null |
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MassBank
|
(3beta,4alpha,7alpha)-3,7,15-Trihydroxy-8-oxo-12,13-epoxytrichothec-9-en-4-yl acetate
|
C17H22O8
| null | null | null | null |
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MassBank
|
Isomarticin
|
C18H16O9
| null | null | null | null |
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MassBank
|
(1S,4S,7R,10S,13S)-7-(2-methylpropyl)-4,10-di(propan-2-yl)-15,16-dithia-3,6,9,12,18-pentazabicyclo[11.4.2]nonadecane-2,5,8,11,19-pentone
|
C22H37N5O5S2
| null | null | null | null |
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MassBank
|
Averufine
|
C20H16O7
| null | null | null | null |
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MassBank
|
N-((1s)-1-(((2s)-1-hydroxy-3-phenyl-propan-2-yl)carbamoyl)-2-phenyl-ethyl)benzamide
|
C25H26N2O3
| null | null | null | null |
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MassBank
|
(4aS,5R,8R,8aS)-N-(7,8-dimethoxy-2-oxochromen-3-yl)-4a,5,8-trihydroxy-4,5,8,8a-tetrahydro-1,2-benzoxazine-3-carboxamide
|
C20H20N2O9
| null | null | null | null |
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MassBank
|
Oxaline
|
C24H25N5O4
| null | null | null | null |
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MassBank
|
Roridin A
|
C29H40O9
| null | null | null | null |
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MassBank
|
Macrofusine
|
C34H59NO15
| null | null | null | null |
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MassBank
|
(1S,2R,3S,4R)-1,2,3,4,8-pentahydroxy-6-methoxy-3-methyl-2,4-dihydro-1H-anthracene-9,10-dione
|
C16H16O8
| null | null | null | null |
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MassBank
|
Fumonisin B4
|
C34H59NO13
| null | null | null | null |
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MassBank
|
Chaetoglobosin A
|
C32H36N2O5
| null | null | null | null |
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MassBank
|
[(6aR,9S,10R,10aR)-7,9-dimethyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-10-yl] acetate
|
C18H22N2O2
| null | null | null | null |
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MassBank
|
15-monoacetyldeoxynivalenol
|
C17H22O7
| null | null | null | null |
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MassBank
|
(2alpha,3alpha,4beta,8alpha)-4,15-bis(acetyloxy)-3-hydroxy-12,13-epoxytrichothec-9-en-8-yl 3-methylbutanoate
|
C24H34O9
| null | null | null | null |
[
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] |
MassBank
|
iso-Roridine E
|
C29H38O8
| null | null | null | null |
[
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MassBank
|
methyl (5S,8S,9S,10R,13R,14R)-17-hydroxy-4,4,8,10,12,13,16-heptamethyl-3,15-dioxo-1,2,5,6,7,9-hexahydrocyclopenta[a]phenanthrene-14-carboxylate
|
C26H36O5
| null | null | null | null |
[
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MassBank
|
12'-Hydroxy-2'-methyl-5'alpha-(phenylmethyl)ergotaman-3',6',18-trione
|
C33H35N5O5
| null | null | null | null |
[
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] |
MassBank
|
Sambucinol
|
C15H22O4
| null | null | null | null |
[
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MassBank
|
(5R,6R,7S)-5,6,7,9,10-pentahydroxy-2-methoxy-7-methyl-6,8-dihydro-5H-anthracene-1,4-dione
|
C16H16O8
| null | null | null | null |
[
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MassBank
|
4-methyl-3'-phenylspiro[1H-1,4-benzodiazepine-3,2'-oxirane]-2,5-dione
|
C17H14N2O3
| null | null | null | null |
[
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{
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MassBank
|
2,4-Dihydroxy-3,5-dimethyl-6-[(2S)-3-oxo-2-butanyl]benzaldehyde
|
C13H16O4
| null | null | null | null |
[
{
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MassBank
|
(3Z)-1,4-dimethyl-3-[[4-(3-methylbut-2-enoxy)phenyl]methylidene]-6-methylsulfanylpiperazine-2,5-dione
|
C19H24N2O3S
| null | null | null | null |
[
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MassBank
|
(1R,3S,5R,7R)-4,4-Dimethyl-13H-spiro[9,14-diazatetracyclo[5.5.2.01,9.03,7]tetradecane-5,2'-indole]-3',8,13(1'H)-trione
|
C21H23N3O3
| null | null | null | null |
[
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MassBank
|
(3alpha,4beta,7alpha)-3,4,7,15-tetrahydroxy-12,13-epoxytrichothec-9-en-8-one
|
C15H20O7
| null | null | null | null |
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MassBank
|
Satratoxin F
|
C29H34O10
| null | null | null | null |
[
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MassBank
|
12'-hydroxy-2'-methyl-5' alpha-(1-methylethyl)-ergotaman-3',6',18-trione
|
C29H35N5O5
| null | null | null | null |
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MassBank
|
Satratoxin G
|
C29H36O10
| null | null | null | null |
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