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
DTXSID80891796 EPA CompTox Dashboard
CB3291098 ChemicalBook
92317 Brenda
ZINC000002029390 ZINC
80705 ChEBI
HY-N6698 MedChemExpress
J9.341F Nikkaji
2MS0D8WA29 FDA SRS
2724362 PubChem
70004200 NMRShiftDB
PD041802 ProbesDrugs
476042 eMolecules
29371354 eMolecules
C16754 KEGG Ligand
The data in this table is sourced from UniChem at EBI.