Compound Synopsis
Compound Overview
Bioactivity Data Summary
Protein Affinity Profile
Cellline Sensitivity Profile

224382 - Overview - Compound Synopsis

Synonyms
CAFFEIC ACIDCaffeic acid
DHCtrans-Caffeate
Molecular Formula
C9H8O4
InChI
InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+
Smiles
O=C(O)/C=C/c1ccc(O)c(O)c1
Cross References
UniChem161247
canSAR224382
PDBe (Protein Data Bank Europe)DHC
ChEMBLCHEMBL145
BindingDB4375
Commercially Available
Yes


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 180.0422587361.19563421Yes