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3',4'-O-dimethylquercetin

PropertiesImage
MNX_IDMNXM511454 Image of MNXM511454
referencechebi:194064
formulaC17H12O7
global charge-2
mol weight328.276
InChIKeyMHALJYZRPGYQSI-UHFFFAOYSA-L
InChIInChI=1S/C17H14O7/c1-22-11-4-3-8(5-12(11)23-2)17-16(21)15(20)14-10(19)6-9(18)7-13(14)24-17/h3-7,18-19,21H,1-2H3/p-2
SMILESCOC1=CC=C(C2=C([O-])C(=O)C3=C(C=C([O-])C=C3O)O2)C=C1OC
MNX internals
InChI (mnx)InChI=1/C17H14O7/c1-22-11-4-3-8(5-12(11)23-2)17-16(21)15(20)14-10(19)6-9(18)7-13(14)24-17/h3-7,18-19,21H,1-2H3 Image of MNXM511454
SMILES (mnx)[CH3:1][O:22][C:11]1=[C:12]([O:23][CH3:2])[CH:5]=[C:8]([C:17]2=[C:16]([OH:21])[C:15](=[O:20])[C:14]3=[C:10]([OH:19])[CH:6]=[C:9]([OH:18])[CH:7]=[C:13]3[O:24]2)[CH:3]=[CH:4]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:194064
chebi:194064
MHALJYZRPGYQSI-UHFFFAOYSA-L 		3',4'-O-dimethylquercetin
3',4'-O-dimethylquercetin 3,7-diolate
quercetin 3',4'-dimethyl ether(2-)
hmdb:HMDB0037354
MHALJYZRPGYQSI-UHFFFAOYSA-N 		3',4'-Di-O-methylquercetin
2-(3,4-Dimethoxyphenyl)-3,5,7-trihydroxy-4H-1-benzopyran-4-one
2-(3,4-Dimethoxyphenyl)-3,5,7-trihydroxy-4H-1-benzopyran-4-one, 9ci
2-(3,4-dimethoxyphenyl)-3,5,7-trihydroxy-4H-chromen-4-one
3',4'-Dimethoxyquercetin
3'4'-O-Dimethylquercetin
5,7-Dihydroxy-3',4'-dimethoxyflavonol
Dillenetin
Sec-butyl benzoate
dillenetin

CHEBI:174458
chebi:174458
MHALJYZRPGYQSI-UHFFFAOYSA-N 		3',4'-Di-O-methylquercetin
2-(3,4-dimethoxyphenyl)-3,5,7-trihydroxychromen-4-one

metacyc.compound:CPD-14949
metacycM:CPD-14949
seed.compound:cpd33207
seedM:cpd33207
MHALJYZRPGYQSI-UHFFFAOYSA-M
MHALJYZRPGYQSI-UHFFFAOYSA-N 		3',4'-dimethylquercetin
quercetin 3',4'-dimethyl ether

lipidmaps:LMPK12112411
lipidmapsM:LMPK12112411
MHALJYZRPGYQSI-UHFFFAOYSA-N 		Dillenetin
3',4'-Dimethoxyquercetin
3,5,7-Trihydroxy-3',4'-dimethoxyflavone

hmdb:HMDB37354
chebi:192776
seedM:M_cpd33207 		secondary/obsolete/fantasy identifier