Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

HPP

Summary
Name:HYDROXYPHENYL PROPIONIC ACID
Formula:C9 H10 O3
Formal charge:0
Formula weight:166.174 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.043-(4-hydroxyphenyl)propanoic acid
OpenEye OEToolkits1.5.03-(4-hydroxyphenyl)propanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(O)CCc1ccc(O)cc1
SMILES_CANONICALCACTVS3.341OC(=O)CCc1ccc(O)cc1
SMILESCACTVS3.341OC(=O)CCc1ccc(O)cc1
SMILES_CANONICALOpenEye OEToolkits1.5.0c1cc(ccc1CCC(=O)O)O
SMILESOpenEye OEToolkits1.5.0c1cc(ccc1CCC(=O)O)O
InChIInChI1.03InChI=1S/C9H10O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-2,4-5,10H,3,6H2,(H,11,12)
InChIKeyInChI1.03NMHMNPHRMNGLLB-UHFFFAOYSA-N

218853

PDB entries from 2024-04-24

PDB statisticsPDBj update infoContact PDBjnumon