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

4HP

Summary
Name:4-HYDROXYPHENYLACETATE
Formula:C8 H8 O3
Formal charge:0
Formula weight:152.147 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.04(4-hydroxyphenyl)acetic acid
OpenEye OEToolkits1.5.02-(4-hydroxyphenyl)ethanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(O)Cc1ccc(O)cc1
SMILES_CANONICALCACTVS3.341OC(=O)Cc1ccc(O)cc1
SMILESCACTVS3.341OC(=O)Cc1ccc(O)cc1
SMILES_CANONICALOpenEye OEToolkits1.5.0c1cc(ccc1CC(=O)O)O
SMILESOpenEye OEToolkits1.5.0c1cc(ccc1CC(=O)O)O
InChIInChI1.03InChI=1S/C8H8O3/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4,9H,5H2,(H,10,11)
InChIKeyInChI1.03XQXPVVBIMDBYFF-UHFFFAOYSA-N

218500

PDB entries from 2024-04-17

PDB statisticsPDBj update infoContact PDBjnumon