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

86176 - Overview - Compound Synopsis

Synonyms
2-OxoisohexanoateCOI
alpha-Ketoisocaproatealpha-Oxoisohexanoate
Molecular Formula
C6H10O3
InChI
InChI=1S/C6H10O3/c1-4(2)3-5(7)6(8)9/h4H,3H2,1-2H3,(H,8,9)
Smiles
CC(C)CC(=O)C(=O)O
Cross References
UniChem439185
canSAR86176
PDBe (Protein Data Bank Europe)COI
ChEMBLCHEMBL445647
BindingDB50390988
Commercially Available
Yes


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 130.062994180.68621319Yes


Compound Lineages


Dosed Drug / Tested Compound(s)Free Compound Form(s)Active Form(s)






Dosed Drug / Tested Compound(s)Free Compound Form(s)Active Form(s)