Dataset

Aflatoxin G2

This MassBank record with Accession MSBNK-AAFC-AC000039 contains the MS2 mass spectrum of Aflatoxin G2 with the InChIkey WPCVRWVBBXIRMA-WNWIJWBNSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C17H14O7/c1-20-9-6-10-12(8-3-5-22-17(8)23-10)14-11(9)7-2-4-21-15(18)13(7)16(19)24-14/h6,8,17H,2-5H2,1H3/t8-,17+/m0/s1
SMILES COC1=C2C3=C(C(=O)OCC3)C(=O)OC2=C4[C@@H]5CCO[C@@H]5OC4=C1
InChI Key WPCVRWVBBXIRMA-WNWIJWBNSA-N
Molecular Formula C17H14O7
Exact Mass 330.074 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-AAFC-AC000039
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:21:34.130497
MetadataModified 2024-01-11T09:21:34.305902
MetadataPublished 2017-07-07
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
476042 eMolecules
29371354 eMolecules
70004200 NMRShiftDB
C16754 KEGG Ligand
DTXSID80891796 EPA CompTox Dashboard
MolPort-003-930-535 MolPort
92317 Brenda
CB3291098 ChemicalBook
2724362 PubChem
PD041802 ProbesDrugs
2MS0D8WA29 FDA SRS
J9.341F Nikkaji
80705 ChEBI
HY-N6698 MedChemExpress
ZINC000002029390 ZINC
The data in this table is sourced from UniChem at EBI.