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sexangularetin

PropertiesImage
MNX_IDMNXM21735 Image of MNXM21735
referencechebi:9131
formulaC16H12O7
global charge0
mol weight316.265
InChIKeyAZFYHRHUTXBGJS-UHFFFAOYSA-N
InChIInChI=1S/C16H12O7/c1-22-15-10(19)6-9(18)11-12(20)13(21)14(23-16(11)15)7-2-4-8(17)5-3-7/h2-6,17-19,21H,1H3
SMILESCOC1=C2OC(C3=CC=C(O)C=C3)=C(O)C(=O)C2=C(O)C=C1O
MNX internals
InChI (mnx)InChI=1/C16H12O7/c1-22-15-10(19)6-9(18)11-12(20)13(21)14(23-16(11)15)7-2-4-8(17)5-3-7/h2-6,17-19,21H,1H3 Image of MNXM21735
SMILES (mnx)[CH3:1][O:22][C:15]1=[C:10]([OH:19])[CH:6]=[C:9]([OH:18])[C:11]2=[C:16]1[O:23][C:14]([C:7]1=[CH:3][CH:5]=[C:8]([OH:17])[CH:4]=[CH:2]1)=[C:13]([OH:21])[C:12]2=[O:20]
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:9131
chebi:9131
AZFYHRHUTXBGJS-UHFFFAOYSA-N 		sexangularetin
3,5,7,4'-tetrahydroxy-8-methoxyflavone
3,5,7-trihydroxy-2-(4-hydroxyphenyl)-8-methoxy-4H-1-benzopyran-4-one
3,5,7-trihydroxy-2-(4-hydroxyphenyl)-8-methoxy-chromen-4-one
8-methoxykaempferol
Herbacetin 8-methyl ether

metacyc.compound:CPD-16764
metacycM:CPD-16764
AZFYHRHUTXBGJS-UHFFFAOYSA-M 		8-methoxykaempferol
3,5,7-Trihydroxy-2-(4-hydroxyphenyl)-8-methoxy-4H-1-benzopyran-4-one

lipidmaps:LMPK12113150
lipidmapsM:LMPK12113150
AZFYHRHUTXBGJS-UHFFFAOYSA-N 		Sexangularetin

seed.compound:cpd07074
seedM:cpd07074
AZFYHRHUTXBGJS-UHFFFAOYSA-L 		Sexangularetin
3,5,7-Trihydroxy-2-(4-hydroxyphenyl)-8-methoxy-4H-1-benzopyran-4-one
8-methoxykaempferol
Herbacetin 8-methyl ether

kegg.compound:C10185
keggC:C10185
AZFYHRHUTXBGJS-UHFFFAOYSA-N 		Sexangularetin
Herbacetin 8-methyl ether

keggC:M_C10185
seedM:M_cpd07074 		secondary/obsolete/fantasy identifier