General
Preferred name
AKBA
Synonyms
3-O-Acetyl-11-keto-β-boswellic acid ()
3-O-Acetyl-11-keto-beta-boswellic acid ()
Acetyl-11-keto-β-boswellic acid ()
P&D ID
PD087577
CAS
67416-61-9
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)
PRICE 120
DESCRIPTION AKBA (3-O-Acetyl-11-keto-beta-boswellic acid), a natural component from frankincense, is a novel activator of Nrf2. (TargetMol Bioactive Compound Library)
Compound Sets
1
TargetMol Bioactive Compound Library
External IDs
9
Properties
(calculated by RDKit )
Molecular Weight
512.35
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
1
Rotatable Bonds
2
Ring Count
5
Aromatic Ring Count
0
cLogP
6.84
TPSA
80.67
Fraction CSP3
0.84
Chiral centers
11.0
Largest ring
6.0
QED
0.41
QED
0.41
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
Endogenous Metabolite
HIF/HIF Prolyl-Hydroxylase
Reactive Oxygen Species
Pathway
Chromatin/Epigenetic
Immunology/Inflammation
Metabolism
NF-κB
Source data