MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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apigenin 4',7-dimethyl ether

	Properties	Image
MNX_ID	MNXM42330
reference	chebi:2769
formula	C₁₇H₁₄O₅
global charge	0
mol weight	298.294
InChIKey	LZERJKGWTQYMBB-UHFFFAOYSA-N
InChI	InChI=1S/C17H14O5/c1-20-11-5-3-10(4-6-11)15-9-14(19)17-13(18)7-12(21-2)8-16(17)22-15/h3-9,18H,1-2H3
SMILES	COC1=CC=C(C2=CC(=O)C3=C(C=C(OC)C=C3O)O2)C=C1

MNX internals

InChI (mnx)	InChI=1/C17H14O5/c1-20-11-5-3-10(4-6-11)15-9-14(19)17-13(18)7-12(21-2)8-16(17)22-15/h3-9,18H,1-2H3
SMILES (mnx)	[CH3:1][O:20][C:11]1=[CH:6][CH:4]=[C:10]([C:15]2=[CH:9][C:14](=[O:19])[C:17]3=[C:13]([OH:18])[CH:7]=[C:12]([O:21][CH3:2])[CH:8]=[C:16]3[O:22]2)[CH:3]=[CH:5]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:2769 chebi:2769 LZERJKGWTQYMBB-UHFFFAOYSA-N	apigenin 4',7-dimethyl ether 4',7-dimethylapigenin 4,7-dimethoxy-5-hydroxyflavone 5-hydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one Apigenin dimethylether apigenin 7,4'-dimethyl ether genkwanin 4'-methyl ether
hmdb:HMDB0132454 LZERJKGWTQYMBB-UHFFFAOYSA-N	Apigenin 7,4'-dimethyl ether 4',7-Di-O-methylapigenin 4',7-Dimethylapigenin 4'-Methoxytectochrysin 4,7-Dimethoxy-5-hydroxyflavone 5-Hydroxy-4',7-dimethoxyflavone 5-Hydroxy-7,4'-dimethoxyflavone 5-Hydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one 5-Hydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-chromen-4-one 5-hydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-chromen-4-one 7,4'-Di-O-methylapigenin 7,4'-Dimethylapigenin 7-Methylacacetin 7-O-Methylacacetin Acacetin 7-methyl ether Apigenin 4',7-dimethyl ether Apigenin dimethyl ether Apigenin dimethylether Apigenin-7,4'-dimethyl ether Apigenin-7,4-dimethyl ether Genkwanin 4'-methyl ether apigenin 7,4'-dimethyl ether
lipidmaps:LMPK12111029 lipidmapsM:LMPK12111029 LZERJKGWTQYMBB-UHFFFAOYSA-N	Apigenin 7,4'-dimethyl ether 5-Hydroxy-4',7-dimethoxyflavone Genkwanin 4'-methyl ether
kegg.compound:C10019 keggC:C10019 LZERJKGWTQYMBB-UHFFFAOYSA-N	Apigenin 7,4'-dimethyl ether Apigenin dimethylether
seed.compound:cpd06909 seedM:cpd06909 LZERJKGWTQYMBB-UHFFFAOYSA-N	Apigenin dimethylether 4',7-dimethylapigenin 5-hydroxy-4',7-dimethoxy-flavone 5-hydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-chromen-4- Apigenin 7,4'-dimethyl ether apigenin-7,4'-dimethyl ether
metacyc.compound:CPD-15631 metacycM:CPD-15631 LZERJKGWTQYMBB-UHFFFAOYSA-N	apigenin-7,4'-dimethyl ether 4',7-dimethylapigenin 5-hydroxy-4',7-dimethoxy-flavone 5-hydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-chromen-4-
keggC:M_C10019 seedM:M_cpd06909	secondary/obsolete/fantasy identifier