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

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pinosylvin

	Properties	Image
MNX_ID	MNXM1369403
reference	chebi:36011
formula	C₁₄H₁₂O₂
global charge	0
mol weight	212.248
InChIKey	YCVPRTHEGLPYPB-UHFFFAOYSA-N
InChI	InChI=1S/C14H12O2/c15-13-8-12(9-14(16)10-13)7-6-11-4-2-1-3-5-11/h1-10,15-16H
SMILES	OC1=CC(O)=CC(C=CC2=CC=CC=C2)=C1

MNX internals

InChI (mnx)	InChI=1/C14H12O2/c15-13-8-12(9-14(16)10-13)7-6-11-4-2-1-3-5-11/h1-10,15-16H/b7-6?
SMILES (mnx)	[CH:1]1=[CH:2][CH:4]=[C:11]([CH:6]=[CH:7][C:12]2=[CH:8][C:13]([OH:15])=[CH:10][C:14]([OH:16])=[CH:9]2)[CH:5]=[CH:3]1

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
Identifier	Description
CHEBI:36011 chebi:36011 YCVPRTHEGLPYPB-UHFFFAOYSA-N	pinosylvin 5-(2-phenylethenyl)-1,3-benzenediol 5-(2-phenylethenyl)benzene-1,3-diol 5-(2-phenylvinyl)benzene-1,3-diol Pinosylvin
hmdb:HMDB0246054 YCVPRTHEGLPYPB-UHFFFAOYSA-N	5-Styrylresorcinol 5-(2-Phenylethenyl)-1,3-benzenediol 5-(2-Phenylvinyl)benzene-1,3-diol 5-(2-phenylethenyl)benzene-1,3-diol pinosylvin
sabiork.compound:5769 sabiorkM:5769 YCVPRTHEGLPYPB-UHFFFAOYSA-N	Pinosylvin
chebi:14840 chebi:8226	secondary/obsolete/fantasy identifier