General
Preferred name
(-)-CATECHIN
Synonyms
(-)-Catechuic acid ()
(-)-Cianidanol ()
(-)-Catechin ()
P&D ID
PD041732
CAS
17334-50-8
75701-31-4
490-46-0
18829-70-4
Tags
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION (-)-Catechin is Catechin's one kind of different structure. Catechin inhibitory enzyme-1 (COX-1), IC50 Ϊ 1.4 ¦ÌM. (-)-Catechin promotes hBM-MSC adipose cell differentiation, increases fat cell differentiation, and PPAR¦Ã level[1][2].
PRICE 111
DESCRIPTION (-)-Catechin ((-)-Cianidanol), an isomer of catechin, inhibits cyclooxygenase-1 (COX-1) with an IC50 of 1.4 ??M.
DESCRIPTION (-)-Catechin ((-)-Cianidanol), an isomer of catechin, inhibits cyclooxygenase-1 (COX-1) with an IC50 of 1.4 μM. (TargetMol Bioactive Compound Library)
Compound Sets
3
Cayman Chemical Bioactives
18644
MedChem Express Bioactive Compound Library
HY-N0898A
TargetMol Bioactive Compound Library
T13597
External IDs
28
Properties
(calculated by RDKit )
Molecular Weight
290.08
Hydrogen Bond Acceptors
6
Hydrogen Bond Donors
5
Rotatable Bonds
1
Ring Count
3
Aromatic Ring Count
2
cLogP
1.55
TPSA
110.38
Fraction CSP3
0.2
Chiral centers
2.0
Largest ring
6.0
QED
0.51
Structural alerts
1
Nonspecific/NOS
IMP
Nuisance compounds
Related compounds
Custom attributes
(extracted from source data)
Target
COX-1
COX
Pathway
Immunology/Inflammation
Neuroscience
Source data