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aflatoxin M1

Properties

Image

Occurences in reactions

MNX_ID

MNXM10605

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	2

formula

C₁₇H₁₂O₇

charge

mass

328.0583

reference

InChIKey

MJBWDEQAUQTVKK-IAGOWNOFSA-N

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

SMILES

COc1cc2c(c3oc(=O)c4c(c13)CCC4=O)[C@]1(O)C=CO[C@@H]1O2

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
reactome:R-ALL-5423629 reactomeM:R-ALL-5423629 CHEBI:78576 chebi:78576	aflatoxin M1 (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 4-Hydroxyaflatoxin B1 AFM1
sabiork.compound:29910 sabiorkM:29910 seed.compound:cpd16553 seedM:cpd16553 kegg.compound:C16756 keggC:C16756	Aflatoxin M1
hmdb:HMDB0030479	Aflatoxin M1 (3R,7R)-3-hydroxy-11-methoxy-6,8,19-trioxapentacyclo[10.7.0.0²,⁹.0³,⁷.0¹³,¹⁷]nonadeca-1(12),2(9),4,10,13(17)-pentaene-16,18-dione 4 Hydroxyaflatoxin b1 4-Hydroxyaflatoxin b1 AFM1 Aflatoxin g1 Aflatoxin m Aflatoxin m1, cis(+-)-isomer
hmdb:HMDB30479 keggC:M_C16756 seedM:M_cpd16553	secondary/obsolete/fantasy identifier