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

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pilosin

	Properties	Image
MNX_ID	MNXM129692
reference	chebi:174456
formula	C₁₇H₁₄O₇
global charge	0
mol weight	330.292
InChIKey	ASAOSMVQLGTAQO-UHFFFAOYSA-N
InChI	InChI=1S/C17H14O7/c1-22-9-5-3-8(4-6-9)11-7-10(18)12-13(19)17(23-2)15(21)14(20)16(12)24-11/h3-7,19-21H,1-2H3
SMILES	COC1=CC=C(C2=CC(=O)C3=C(O2)C(O)=C(O)C(OC)=C3O)C=C1

MNX internals

InChI (mnx)	InChI=1/C17H14O7/c1-22-9-5-3-8(4-6-9)11-7-10(18)12-13(19)17(23-2)15(21)14(20)16(12)24-11/h3-7,19-21H,1-2H3
SMILES (mnx)	[CH3:1][O:22][C:9]1=[CH:6][CH:4]=[C:8]([C:11]2=[CH:7][C:10](=[O:18])[C:12]3=[C:13]([OH:19])[C:17]([O:23][CH3:2])=[C:15]([OH:21])[C:14]([OH:20])=[C:16]3[O:24]2)[CH:3]=[CH:5]1

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
Identifier	Description
CHEBI:174456 chebi:174456 ASAOSMVQLGTAQO-UHFFFAOYSA-N	pilosin 4',6-dimethoxy-5,7,8-trihydroxyflavone 5,7,8-trihydroxy-4',6-dimethoxyflavone 5,7,8-trihydroxy-6,4'-dimethoxyflavone 5,7,8-trihydroxy-6-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one 5,7,8-trihydroxy-6-methoxy-2-(4-methoxyphenyl)-4H-chromen-4-one 5,7,8-trihydroxy-6-methoxy-2-(4-methoxyphenyl)chromen-4-one
seed.compound:cpd32712 seedM:cpd32712 ASAOSMVQLGTAQO-UHFFFAOYSA-M	4H-1-benzopyran-4-one, 5,7,8-trihydroxy-6-methoxy-2-(4-methoxyphenyl)- pilosin
hmdb:HMDB0037096 ASAOSMVQLGTAQO-UHFFFAOYSA-N	Pilosin 5,7,8-Trihydroxy-4',6-dimethoxyflavone 5,7,8-trihydroxy-6-methoxy-2-(4-methoxyphenyl)-4H-chromen-4-one 5,7,8-trihydroxy-6-methoxy-2-(4-methoxyphenyl)chromen-4-one
metacyc.compound:CPD-15473 metacycM:CPD-15473 ASAOSMVQLGTAQO-UHFFFAOYSA-N	pilosin 4H-1-benzopyran-4-one, 5,7,8-trihydroxy-6-methoxy-2-(4-methoxyphenyl)-
hmdb:HMDB37096 seedM:M_cpd32712	secondary/obsolete/fantasy identifier