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3',4',5,6-tetrahydroxy-3,7-dimethoxyflavone

PropertiesImage
MNX_IDMNXM3830 Image of MNXM3830
referencechebi:77769
formulaC17H13O8
global charge-1
mol weight345.283
InChIKeyWGWGXVOAFMLMJZ-UHFFFAOYSA-M
InChIInChI=1S/C17H14O8/c1-23-11-6-10-12(14(21)13(11)20)15(22)17(24-2)16(25-10)7-3-4-8(18)9(19)5-7/h3-6,18-21H,1-2H3/p-1
SMILESCOC1=CC2=C(C(=O)C(OC)=C(C3=CC(O)=C(O)C=C3)O2)C([O-])=C1O
MNX internals
InChI (mnx)InChI=1/C17H14O8/c1-23-11-6-10-12(14(21)13(11)20)15(22)17(24-2)16(25-10)7-3-4-8(18)9(19)5-7/h3-6,18-21H,1-2H3 Image of MNXM3830
SMILES (mnx)[CH3:1][O:23][C:11]1=[C:13]([OH:20])[C:14]([OH:21])=[C:12]2[C:10](=[CH:6]1)[O:25][C:16]([C:7]1=[CH:5][C:9]([OH:19])=[C:8]([OH:18])[CH:4]=[CH:3]1)=[C:17]([O:24][CH3:2])[C:15]2=[O:22]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:77769
chebi:77769
WGWGXVOAFMLMJZ-UHFFFAOYSA-M 		3',4',5,6-tetrahydroxy-3,7-dimethoxyflavone
2-(3,4-dihydroxyphenyl)-6-hydroxy-3,7-dimethoxy-4-oxo-4H-chromen-5-olate
3',4',5,6-tetrahydroxy-3,7-dimethoxyflavone(1-)

seed.compound:cpd02790
seedM:cpd02790
WGWGXVOAFMLMJZ-UHFFFAOYSA-M 		3',4',5,6-Tetrahydroxy-3,7-dimethoxyflavone
3',4',5,6-tetrahydroxy-3,7-dimethoxyflavone
3,7-di-methylquercetagetin
3,7-dimethylquercetagetin
Tomentin

CHEBI:27767
chebi:27767
WGWGXVOAFMLMJZ-UHFFFAOYSA-N 		3',4',5,6-tetrahydroxy-3,7-dimethoxyflavone
2-(3,4-dihydroxyphenyl)-5,6-dihydroxy-3,7-dimethoxy-4H-chromen-4-one
3',4',5,6-Tetrahydroxy-3,7-dimethoxyflavone
3,7-dimethylquercetagetin
tomentin

metacyc.compound:CPD-10527
metacycM:CPD-10527
WGWGXVOAFMLMJZ-UHFFFAOYSA-N 		3,7-dimethylquercetagetin
3',4',5,6-tetrahydroxy-3,7-dimethoxyflavone

kegg.compound:C04581
keggC:C04581
WGWGXVOAFMLMJZ-UHFFFAOYSA-N 		Tomentin
3',4',5,6-Tetrahydroxy-3,7-dimethoxyflavone

lipidmaps:LMPK12112991
lipidmapsM:LMPK12112991
WGWGXVOAFMLMJZ-UHFFFAOYSA-N 		Tomentin
3,7-Dimethylquercetagetin
5,6,3',4'-Tetrahydroxy-3,7-dimethoxyflavone

chebi:11668
chebi:1318
chebi:19821
keggC:M_C04581
seedM:M_cpd02790 		secondary/obsolete/fantasy identifier