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3',4',5-trihydroxy-3,7-dimethoxyflavone

PropertiesImage
MNX_IDMNXM2325 Image of MNXM2325
referencechebi:77710
formulaC17H13O7
global charge-1
mol weight329.284
InChIKeyLUJAXSNNYBCFEE-UHFFFAOYSA-M
InChIInChI=1S/C17H14O7/c1-22-9-6-12(20)14-13(7-9)24-16(17(23-2)15(14)21)8-3-4-10(18)11(19)5-8/h3-7,18-20H,1-2H3/p-1
SMILESCOC1=CC2=C(C(=O)C(OC)=C(C3=CC(O)=C(O)C=C3)O2)C([O-])=C1
MNX internals
InChI (mnx)InChI=1/C17H14O7/c1-22-9-6-12(20)14-13(7-9)24-16(17(23-2)15(14)21)8-3-4-10(18)11(19)5-8/h3-7,18-20H,1-2H3 Image of MNXM2325
SMILES (mnx)[CH3:1][O:22][C:9]1=[CH:6][C:12]([OH:20])=[C:14]2[C:13](=[CH:7]1)[O:24][C:16]([C:8]1=[CH:5][C:11]([OH:19])=[C:10]([OH:18])[CH:4]=[CH:3]1)=[C:17]([O:23][CH3:2])[C:15]2=[O:21]
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:77710
chebi:77710
LUJAXSNNYBCFEE-UHFFFAOYSA-M 		3',4',5-trihydroxy-3,7-dimethoxyflavone
2-(3,4-dihydroxyphenyl)-3,7-dimethoxy-4-oxo-4H-chromen-5-olate
3',4',5-trihydroxy-3,7-dimethoxyflavone(1-)

CHEBI:18010
chebi:18010
LUJAXSNNYBCFEE-UHFFFAOYSA-N 		3',4',5-trihydroxy-3,7-dimethoxyflavone
2-(3,4-Dihydroxyphenyl)-5-hydroxy-3,7-dimethoxy-4-benzopyrone
2-(3,4-dihydroxyphenyl)-5-hydroxy-3,7-dimethoxy-4H-chromen-4-one
3',4',5-Trihydroxy-3,7-dimethoxyflavone
3,7-Di-O-methylquercetin
3,7-O-dimethylquercetin

kegg.compound:C01265
keggC:C01265
LUJAXSNNYBCFEE-UHFFFAOYSA-N 		3,7-Di-O-methylquercetin
3',4',5-Trihydroxy-3,7-dimethoxyflavone

seed.compound:cpd00928
seedM:cpd00928
LUJAXSNNYBCFEE-UHFFFAOYSA-N 		3,7-Di-O-methylquercetin
3',4',5-Trihydroxy-3,7-dimethoxyflavone
3',4',5-trihydroxy-3,7-dimethoxyflavone
3,7-di-O-methylquercetin
3,7-dimethylquercetin
hmdb:HMDB0029263
LUJAXSNNYBCFEE-UHFFFAOYSA-N 		3,7-Dimethylquercetin
2-(3,4-Dihydroxyphenyl)-5-hydroxy-3,7-dimethoxy-4-benzopyrone
2-(3,4-dihydroxyphenyl)-5-hydroxy-3,7-dimethoxy-4H-chromen-4-one
3',4',5-Trihydroxy-3,7-dimethoxyflavone
3,7-Di-O-methylquercetin
3,7-Dimethoxy-5,3',4'-trihydroxyflavone
3,7-O-Dimethylquercetin
5,3',4'-Trihydroxy-3,7-dimethoxyflavone
DTHF
Quercetin 3,7-dimethyl ether

metacyc.compound:345-TRIHYDROXY-37-DIMETHOXYFLAVONE
metacycM:345-TRIHYDROXY-37-DIMETHOXYFLAVONE
LUJAXSNNYBCFEE-UHFFFAOYSA-N 		3,7-dimethylquercetin
3',4',5-trihydroxy-3,7-dimethoxyflavone
3,7-di-O-methylquercetin

lipidmaps:LMPK12112731
lipidmapsM:LMPK12112731
LUJAXSNNYBCFEE-UHFFFAOYSA-N 		Quercetin 3,7-dimethyl ether
5,3',4'-Trihydroxy-3,7-dimethoxyflavone

hmdb:HMDB29263
chebi:11671
chebi:11672
chebi:1321
chebi:19824
keggC:M_C01265
seedM:M_cpd00928 		secondary/obsolete/fantasy identifier