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aflatoxin M1

Go to external page http://purl.obolibrary.org/obo/CHEBI_78576

A member of the class of aflatoxins that is aflatoxin B1 in which the hydrogen at position 9a is replaced by a hydroxy group.

Term info

Label

aflatoxin M1

Synonyms
  • (6aR,9aR)-9a-hydroxy-4-methoxy-2,3,6a,9a-tetrahydrocyclopenta[c]furo[3',2':4,5]furo[2,3-h]chromene-1,11-dione
database cross reference
Subsets

3_STAR

IUPAC NAME
(6aR,9aR)-9a-hydroxy-4-methoxy-2,3,6a,9a-tetrahydrocyclopenta[c]furo[3',2':4,5]furo[2,3-h]chromene-1,11-dione [ IUPAC ]

charge

0

formula

C17H12O7

has obo namespace

chebi_ontology

has related synonym

4-Hydroxyaflatoxin B1, AFM1

id

CHEBI:78576

inchi

InChI=1S/C17H12O7/c1-21-9-6-10-13(17(20)4-5-22-16(17)23-10)14-12(9)7-2-3-8(18)11(7)15(19)24-14/h4-6,16,20H,2-3H2,1H3/t16-,17-/m1/s1

inchikey

MJBWDEQAUQTVKK-IAGOWNOFSA-N

mass

328.27300

monoisotopicmass

328.05830

smiles

COc1cc2O[C@H]3OC=C[C@@]3(O)c2c2oc(=O)c3C(=O)CCc3c12