General
Preferred name
BACCATIN III
Synonyms
CEPHALOMANNINE ()
P&D ID
PD041408
CAS
71610-00-9
Tags
available
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
PRICE
50
DESCRIPTION
Cephalomannine (Baccatin III) is a taxol derivative obtained from Taxus yunnanensis with antitumor activity.
(TargetMol Bioactive Compound Library)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
1
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
12
Molecular Weight
831.35
Hydrogen Bond Acceptors
14
Hydrogen Bond Donors
4
Rotatable Bonds
10
Ring Count
6
Aromatic Ring Count
2
cLogP
3.39
TPSA
221.29
Fraction CSP3
0.51
Chiral centers
11.0
Largest ring
8.0
QED
0.12
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
Microtubule/Tubulin
MOA
Microtubule Associated
Pathway
Cytoskeletal Signaling
Source data
