General
Preferred name
BRUCEANTIN
Synonyms
(-)-Bruceantin ()
NCI165563 ()
NSC165563 ()
P&D ID
PD011819
CAS
41451-75-6
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 Bruceantin ((-)-Bruceantin) is a quassinoid found in B. javanica. Bruceantin activates caspase signaling pathway, causes the mitochondrial dysfunction, inhibits cell proliferation, induces cell differentiation and apoptosis. Bruceantin exhibits anti-leukemia and antiprotozoal activities[1][2][3].
PRICE 527
DESCRIPTION Bruceantin (NSC-165563) is a natural product isolated from Brucea antidysenterica. Bruceantin has antitumor activity against B16 melanoma, colon 38, and L1210 and P388 leukemia in mice.
DESCRIPTION Bruceantin is first isolated from Brucea antidysenterica, a tree used in Ethiopia for the treatment of cancer, and activity was observed against B16 melanoma, colon 38, and L1210 and P388 leukemia in mice. (BOC Sciences Bioactive Compounds)
Cell lines
6
Organisms
0
Compound Sets
5
BOC Sciences Bioactive Compounds
bruceantin-cas-41451-75-6-item-84-117094
Cayman Chemical Bioactives
33973
MedChem Express Bioactive Compound Library
HY-N0840
NIH Mechanistic Set
ReFrame library
External IDs
18
Properties
(calculated by RDKit )
Molecular Weight
548.23
Hydrogen Bond Acceptors
11
Hydrogen Bond Donors
3
Rotatable Bonds
4
Ring Count
5
Aromatic Ring Count
0
cLogP
1.15
TPSA
165.89
Fraction CSP3
0.71
Chiral centers
10.0
Largest ring
6.0
QED
0.26
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
Apoptosis
Caspase
c-Myc
Mitochondrial Metabolism
Parasite
Pathway
Anti-infection
Metabolic Enzyme/Protease
Source data