Loading
PDBj
MenuPDBj@FacebookPDBj@X(formerly Twitter)PDBj@BlueSkyPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

8OZ

Summary
Name:2-Phenylacrylic acid
Formula:C9 H8 O2
Formal charge:0
Formula weight:148.159 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.62-phenylprop-2-enoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C9H8O2/c1-7(9(10)11)8-5-3-2-4-6-8/h2-6H,1H2,(H,10,11)
InChIKeyInChI1.03ONPJWQSDZCGSQM-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385OC(=O)C(=C)c1ccccc1
SMILESCACTVS3.385OC(=O)C(=C)c1ccccc1
SMILES_CANONICALOpenEye OEToolkits2.0.6C=C(c1ccccc1)C(=O)O
SMILESOpenEye OEToolkits2.0.6C=C(c1ccccc1)C(=O)O

227344

PDB entries from 2024-11-13

PDB statisticsPDBj update infoContact PDBjnumon