Aflatoxin G1

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Systematic / IUPAC Name: 5-Methoxy-3,4,7α,10a-tetrahydro-1H,12H-furo[3',2':4,5]furo[2,3-h]pyrano[3,4-c]chromene-1,12-dione

ID: Reference301

Other Names: 1H,12H-Furo[3',2':4,5]furo[2,3-H]pyrano[3,4-c][1]benzopyran-1,12-dione, 3,4,7a,10a-tetrahydro-5-methoxy-, (7aR,10aS)-;
(7aR,10aS)-5-Methoxy-3,4,7a,10a-tetrahydro-1H,12H-furo[3',2':4,5]furo[2,3-H]pyrano[3,4-c]chromene-1,12-dione

Formula: C17H12O7

Class: Endogenous Metabolites Natural Toxins

Spectral Data

Aflatoxin G1 mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 3
No. of Spectra 4145
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods ESI; NSI
Analyzers IT; FT
Last Modification 12/11/2014 3:24:17 PM
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Identificators

InChI InChI=1S/C17H12O7/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/h3,5-6,8,17H,2,4H2,1H3/t8-,17+/m0/s1
InChI Key XWIYFDMXXLINPU-WNWIJWBNSA-N
Canonical SMILES COC1=C2C3=C(C(=O)OCC3)C(=O)OC2=C4C5C=COC5OC4=C1
CAS 1165395
Splash
Other Names 1H,12H-Furo[3',2':4,5]furo[2,3-H]pyrano[3,4-c][1]benzopyran-1,12-dione, 3,4,7a,10a-tetrahydro-5-methoxy-, (7aR,10aS)-;
(7aR,10aS)-5-Methoxy-3,4,7a,10a-tetrahydro-1H,12H-furo[3',2':4,5]furo[2,3-H]pyrano[3,4-c]chromene-1,12-dione

In Other Databases

Wikipedia Aflatoxin
PubChem 2724361
KEGG C16755
ChemSpider 2006508