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3,3',4',5,7-pentahydroxy-8-methoxyflavone

PropertiesImage
MNX_IDMNXM4311 Image of MNXM4311
referencechebi:58544
formulaC16H11O8
global charge-1
mol weight331.256
InChIKeyZASFHSAGASJGRN-UHFFFAOYSA-M
InChIInChI=1S/C16H12O8/c1-23-15-10(20)5-9(19)11-12(21)13(22)14(24-16(11)15)6-2-3-7(17)8(18)4-6/h2-5,17-20,22H,1H3/p-1
SMILESCOC1=C(O)C=C(O)C2=C1OC(C1=CC(O)=C(O)C=C1)=C([O-])C2=O
MNX internals
InChI (mnx)InChI=1/C16H12O8/c1-23-15-10(20)5-9(19)11-12(21)13(22)14(24-16(11)15)6-2-3-7(17)8(18)4-6/h2-5,17-20,22H,1H3 Image of MNXM4311
SMILES (mnx)[CH3:1][O:23][C:15]1=[C:10]([OH:20])[CH:5]=[C:9]([OH:19])[C:11]2=[C:16]1[O:24][C:14]([C:6]1=[CH:4][C:8]([OH:18])=[C:7]([OH:17])[CH:3]=[CH:2]1)=[C:13]([OH:22])[C:12]2=[O:21]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:58544
chebi:58544
ZASFHSAGASJGRN-UHFFFAOYSA-M 		3,3',4',5,7-pentahydroxy-8-methoxyflavone
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-8-methoxy-4-oxo-4H-chromen-3-olate
3',4',5,7-pentahydroxy-8-methoxyflavon-3-olate

seed.compound:cpd02757
seedM:cpd02757
ZASFHSAGASJGRN-UHFFFAOYSA-L 		3,3',4',5,7-Pentahydroxy-8-methoxyflavone
3,3',4',5,7-pentahydroxy-8-methoxyflavone
Corniculatusin
corniculatusin
gossypetin 8-methyl ester

CHEBI:28018
chebi:28018
ZASFHSAGASJGRN-UHFFFAOYSA-N 		3,3',4',5,7-pentahydroxy-8-methoxyflavone
2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-8-methoxy-4H-chromen-4-one
3,3',4',5,7-Pentahydroxy-8-methoxyflavone
8-methoxyquercetin
corniculatusin

metacyc.compound:33457-PENTAHYDROXY-8-METHOXYFLAVON
metacycM:33457-PENTAHYDROXY-8-METHOXYFLAVON
ZASFHSAGASJGRN-UHFFFAOYSA-M 		3,3',4',5,7-pentahydroxy-8-methoxyflavone
corniculatusin
gossypetin 8-methyl ester

lipidmaps:LMPK12113234
lipidmapsM:LMPK12113234
ZASFHSAGASJGRN-UHFFFAOYSA-N 		Corniculatusin

kegg.compound:C04527
keggC:C04527
ZASFHSAGASJGRN-UHFFFAOYSA-N 		Corniculatusin
3,3',4',5,7-Pentahydroxy-8-methoxyflavone

chebi:11683
chebi:1363
chebi:19861
keggC:M_C04527
seedM:M_cpd02757 		secondary/obsolete/fantasy identifier