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

Feedback

3-(3-hydroxyphenyl)propanoate

	Properties	Image
MNX_ID	MNXM1634
reference	chebi:57277
formula	C₉H₉O₃
global charge	-1
mol weight	165.168
InChIKey	QVWAEZJXDYOKEH-UHFFFAOYSA-M
InChI	InChI=1S/C9H10O3/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-3,6,10H,4-5H2,(H,11,12)/p-1
SMILES	O=C([O-])CCC1=CC(O)=CC=C1

MNX internals

InChI (mnx)	InChI=1/C9H10O3/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-3,6,10H,4-5H2,(H,11,12)
SMILES (mnx)	[CH:1]1=[CH:2][C:7]([CH2:4][CH2:5][C:9](=[O:11])[OH:12])=[CH:6][C:8]([OH:10])=[CH:3]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	6
in models (compartimentalized)	8

Similar chemical compounds in external resources
Identifier	Description
CHEBI:57277 chebi:57277 QVWAEZJXDYOKEH-UHFFFAOYSA-M	3-(3-hydroxyphenyl)propanoate 3-(3-hydroxyphenyl)propionate
hmdb:HMDB0000375 QVWAEZJXDYOKEH-UHFFFAOYSA-N	3-(3-Hydroxyphenyl)propanoic acid 3-(3'-Hydroxyphenyl)propanoic acid 3-(3-Hydroxy-phenyl)-propanoate 3-(3-Hydroxy-phenyl)-propanoic acid 3-(3-Hydroxy-phenyl)-propionic acid 3-(3-Hydroxyphenyl)propanoate 3-(3-Hydroxyphenyl)propionate 3-(3-hydroxyphenyl)propanoic acid 3-(m-Hydroxyphenyl)propionate 3-(m-Hydroxyphenyl)propionic acid 3-Hydroxybenzenepropanoate 3-Hydroxybenzenepropanoic acid 3-Hydroxydihydrocinnamate 3-Hydroxydihydrocinnamic acid 3-Hydroxyhydrocinnamic acid 3-Hydroxyphenylpropanoate 3-Hydroxyphenylpropanoic acid 3-Hydroxyphenylpropionate 3-Hydroxyphenylpropionic acid 3-hydroxyphenylpropionic acid Dihydro-3-coumarate Dihydro-3-coumaric acid b-(3-Hydroxyphenyl)propionate b-(3-Hydroxyphenyl)propionic acid b-(m-Hydroxyphenyl)propionate b-(m-Hydroxyphenyl)propionic acid beta-(3-Hydroxyphenyl)propionate beta-(3-Hydroxyphenyl)propionic acid beta-(m-Hydroxyphenyl)propionate beta-(m-Hydroxyphenyl)propionic acid beta-(m-hydroxyphenyl)propionate beta-(m-hydroxyphenyl)propionic acid dihydro-3-Coumaric acid, monosodium salt dihydro-m-Coumarate dihydro-m-Coumaric acid m-Hydrocoumaric acid m-Hydroxy-hydrocinnamate m-Hydroxy-hydrocinnamic acid m-Hydroxyphenylpropionate m-Hydroxyphenylpropionic acid
kegg.compound:C11457 keggC:C11457 QVWAEZJXDYOKEH-UHFFFAOYSA-N	3-(3-Hydroxyphenyl)propanoic acid 3-(3-Hydroxyphenyl)propanoate 3-Hydroxyphenylpropanoate Dihydro-3-coumaric acid
bigg.metabolite:3hpppn biggM:3hpppn QVWAEZJXDYOKEH-UHFFFAOYSA-M	3-(3-hydroxy-phenyl)propionate
vmhM:3hpppn vmhmetabolite:3hpppn QVWAEZJXDYOKEH-UHFFFAOYSA-M	3-(3-hydroxy-phenyl)propionate 3-(3-hydroxyphenyl)propanoic acid
metacyc.compound:3-HYDROXYPHENYL-PROPIONATE metacycM:3-HYDROXYPHENYL-PROPIONATE QVWAEZJXDYOKEH-UHFFFAOYSA-M	3-(3-hydroxyphenyl)propanoate 3-(3-hydroxyphenyl)propanoic acid 3-(3-hydroxyphenyl)propionate 3-(3-hydroxyphenyl)propionic acid 3HPP MHP dihydro-3-coumarate m-hydroxyphenylpropionate m-hydroxyphenylpropionic acid
CHEBI:1427 chebi:1427 QVWAEZJXDYOKEH-UHFFFAOYSA-N	3-(3-hydroxyphenyl)propanoic acid 3-(3-Hydroxy-phenyl)-propanoic acid 3-(3-hydroxyphenyl)propionic acid 3-(m-hydroxyphenyl)propionic acid Dihydro-3-coumaric acid beta-(m-hydroxyphenyl)propionic acid
vmhM:3hppa vmhmetabolite:3hppa QVWAEZJXDYOKEH-UHFFFAOYSA-M	3-hydroxyphenylpropionic acid (3-HPPA) 3-(3-hydroxyphenyl)propanoic acid
seed.compound:cpd08304 seedM:cpd08304 QVWAEZJXDYOKEH-UHFFFAOYSA-M	Dihydro-3-coumaric acid 3-(3-Hydroxy-phenyl)-propanoic acid 3-(3-Hydroxyphenyl)propanoate 3-(3-Hydroxyphenyl)propanoic acid 3-(3-hydroxy-phenyl)propionate 3-(3-hydroxyphenyl)propanoate 3-(3-hydroxyphenyl)propanoic acid 3-(3-hydroxyphenyl)propionate 3-(3-hydroxyphenyl)propionic acid 3-Hydroxyphenylpropanoate 3HPP 3hpppn MHP dihydro-3-coumarate m-hydroxyphenylpropionate m-hydroxyphenylpropionic acid
hmdb:HMDB00375 biggM:M_3hpppn keggC:M_C11457 seedM:M_cpd08304 vmhM:M_3hppa vmhM:M_3hpppn	secondary/obsolete/fantasy identifier