General
Preferred name
SENECIPHYLLINE
Synonyms
P&D ID
PD053435
CAS
480-81-9
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)
DESCRIPTION Seneciphylline is an orally effective hepatotoxic inducer. Seneciphylline is metabolized by CYP450 enzymes into active intermediates, which covalently bind to intracellular biomacromolecules such as proteins and DNA to form adducts, which in turn trigger a series of toxic reactions, such as inducing cell apoptosis and damaging mitochondrial function. Seneciphylline can be used in hepatotoxicity research[1][2].
PRICE 171
DESCRIPTION Seneciphylline, one of the hepatotoxic pyrolizidine alkaloids, has mutagenic activity in Drosophila and their transfer into rat milk.Seneciphylline can significantly increased the activities of epoxide hydrase and glutathione-S-transferase but cause reduction of cytochrome P-450 and related monooxygenase activities. (TargetMol Bioactive Compound Library)
Compound Sets
3
Cayman Chemical Bioactives
25146
MedChem Express Bioactive Compound Library
HY-N1282
TargetMol Bioactive Compound Library
TN1078
External IDs
29
Properties
(calculated by RDKit )
Molecular Weight
333.16
Hydrogen Bond Acceptors
6
Hydrogen Bond Donors
1
Rotatable Bonds
0
Ring Count
3
Aromatic Ring Count
0
cLogP
1.11
TPSA
76.07
Fraction CSP3
0.56
Chiral centers
3.0
Largest ring
12.0
QED
0.41
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Metabolism
oxidation-reduction
Metabolic Enzyme/Protease
Target
Cytochrome P450
Glutathione S-transferase
GST
p450
Source data