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3',4',5-trihydroxy-3,6,7-trimethoxyflavone

PropertiesImage
MNX_IDMNXM4312 Image of MNXM4312
referencechebi:18016
formulaC18H16O8
global charge0
mol weight360.318
InChIKeyBYWLLSQTJBXAPV-UHFFFAOYSA-N
InChIInChI=1S/C18H16O8/c1-23-12-7-11-13(14(21)17(12)24-2)15(22)18(25-3)16(26-11)8-4-5-9(19)10(20)6-8/h4-7,19-21H,1-3H3
SMILESCOC1=CC2=C(C(=O)C(OC)=C(C3=CC(O)=C(O)C=C3)O2)C(O)=C1OC
MNX internals
InChI (mnx)InChI=1/C18H16O8/c1-23-12-7-11-13(14(21)17(12)24-2)15(22)18(25-3)16(26-11)8-4-5-9(19)10(20)6-8/h4-7,19-21H,1-3H3 Image of MNXM4312
SMILES (mnx)[CH3:1][O:23][C:12]1=[C:17]([O:24][CH3:2])[C:14]([OH:21])=[C:13]2[C:11](=[CH:7]1)[O:26][C:16]([C:8]1=[CH:6][C:10]([OH:20])=[C:9]([OH:19])[CH:5]=[CH:4]1)=[C:18]([O:25][CH3:3])[C:15]2=[O:22]
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:18016
chebi:18016
BYWLLSQTJBXAPV-UHFFFAOYSA-N 		3',4',5-trihydroxy-3,6,7-trimethoxyflavone
2-(3,4-dihydroxyphenyl)-5-hydroxy-3,6,7-trimethoxy-4H-chromen-4-one
3',4',5-Trihydroxy-3,6,7-trimethoxyflavone
Chrysosplenol D
quercetagetin 3,6,7-trimethyl ether

seed.compound:cpd02771
seedM:cpd02771
BYWLLSQTJBXAPV-UHFFFAOYSA-N 		3',4',5-Trihydroxy-3,6,7-trimethoxyflavone
3',4',5-trihydroxy-3,6,7-trimethoxyflavone
3,6,7-trimethylquercetagetin
5,3',4'-trihydroxy 3,6,7-trimethylquercetagetin
Chrysosplenol D

metacyc.compound:345-TRIHYDROXY-367-TRIMETHOXYFLAVO
metacycM:345-TRIHYDROXY-367-TRIMETHOXYFLAVO
BYWLLSQTJBXAPV-UHFFFAOYSA-N 		3,6,7-trimethylquercetagetin
3',4',5-trihydroxy-3,6,7-trimethoxyflavone
5,3',4'-trihydroxy 3,6,7-trimethylquercetagetin

kegg.compound:C04552
keggC:C04552
BYWLLSQTJBXAPV-UHFFFAOYSA-N 		Chrysosplenol D
3',4',5-Trihydroxy-3,6,7-trimethoxyflavone

lipidmaps:LMPK12112998
lipidmapsM:LMPK12112998
BYWLLSQTJBXAPV-UHFFFAOYSA-N 		Chrysosplenol D
5,3',4'-Trihydroxy-3,6,7-trimethoxyflavone
Quercetagetin 3,6,7-Trimethyl ether

chebi:11670
chebi:1320
chebi:19823
keggC:M_C04552
seedM:M_cpd02771 		secondary/obsolete/fantasy identifier