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

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salvigenin

	Properties	Image
MNX_ID	MNXM81447
reference	chebi:192703
formula	C₁₈H₁₆O₆
global charge	0
mol weight	328.32
InChIKey	QCDYOIZVELGOLZ-UHFFFAOYSA-N
InChI	InChI=1S/C18H16O6/c1-21-11-6-4-10(5-7-11)13-8-12(19)16-14(24-13)9-15(22-2)18(23-3)17(16)20/h4-9,20H,1-3H3
SMILES	COC1=CC=C(C2=CC(=O)C3=C(C=C(OC)C(OC)=C3O)O2)C=C1

MNX internals

InChI (mnx)	InChI=1/C18H16O6/c1-21-11-6-4-10(5-7-11)13-8-12(19)16-14(24-13)9-15(22-2)18(23-3)17(16)20/h4-9,20H,1-3H3
SMILES (mnx)	[CH3:1][O:21][C:11]1=[CH:7][CH:5]=[C:10]([C:13]2=[CH:8][C:12](=[O:19])[C:16]3=[C:14]([CH:9]=[C:15]([O:22][CH3:2])[C:18]([O:23][CH3:3])=[C:17]3[OH:20])[O:24]2)[CH:4]=[CH:6]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	6
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:192703 chebi:192703 QCDYOIZVELGOLZ-UHFFFAOYSA-N	salvigenin 5-hydroxy-4',6,7-trimethoxyflavone 5-hydroxy-6,7,4'-trimethoxy-flavone 5-hydroxy-6,7,4'-trimethoxyflavone 5-hydroxy-6,7-dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one 5-hydroxy-6,7-dimethoxy-2-(4-methoxyphenyl)-4H-chromen-4-one 7-O-methylpectolinarigenin psathyrotin
seed.compound:cpd34293 seedM:cpd34293 QCDYOIZVELGOLZ-UHFFFAOYSA-M	4H-1-Bbenzopyran-4-one, 5-hydroxy-6,7-dimethoxy-2-(4-methoxyphenyl)- 5-hydroxy-4',6,7-trimethoxyflavone 5-hydroxy-6,7,4'-trimethoxyflavone 7-O-methylpectolinarigenin flavone, 5-hydroxy-4',6,7-trimethoxy- psathyrotin salvigenin
lipidmaps:LMPK12111166 lipidmapsM:LMPK12111166 QCDYOIZVELGOLZ-UHFFFAOYSA-N	Salvigenin
hmdb:HMDB0128577 QCDYOIZVELGOLZ-UHFFFAOYSA-N	Salvigenin 5-Desmethyltetraraethylscutellarein 5-Hydroxy-4',6,7-trimethoxyflavone 5-Hydroxy-6,7,4'-trimethoxy-flavone 5-Hydroxy-6,7,4'-trimethoxyflavone 5-Hydroxy-6,7-dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one 5-hydroxy-6,7-dimethoxy-2-(4-methoxyphenyl)-4H-chromen-4-one 7-O-Methylpectolinarigenin Psathyrotin salvigenin
metacyc.compound:CPD-15477 metacycM:CPD-15477 QCDYOIZVELGOLZ-UHFFFAOYSA-N	salvigenin 4H-1-Bbenzopyran-4-one, 5-hydroxy-6,7-dimethoxy-2-(4-methoxyphenyl)- 5-hydroxy-4',6,7-trimethoxyflavone 5-hydroxy-6,7,4'-trimethoxyflavone 7-O-methylpectolinarigenin flavone, 5-hydroxy-4',6,7-trimethoxy- psathyrotin
seedM:M_cpd34293	secondary/obsolete/fantasy identifier