General
Preferred name
PICROSIDE II
Synonyms
6-Vanilloylcatalpol ()
Vanilloyl catalpol ()
P&D ID
PD056263
CAS
39012-20-9
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 37
DESCRIPTION Picroside II (Vanilloyl catalpol) is the main active ingredient in iridoid glycosides. It has antioxidant, anti-inflammatory, immune regulatory, anti-virus and other pharmacological activities. (TargetMol Bioactive Compound Library)
Compound Sets
1
TargetMol Bioactive Compound Library
External IDs
8
Properties
(calculated by RDKit )
Molecular Weight
512.15
Hydrogen Bond Acceptors
13
Hydrogen Bond Donors
6
Rotatable Bonds
7
Ring Count
5
Aromatic Ring Count
1
cLogP
-2.01
TPSA
197.13
Fraction CSP3
0.61
Chiral centers
11.0
Largest ring
6.0
QED
0.17
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
Apoptosis
Influenza Virus
NF-κB
Reactive Oxygen Species
NF-¦ÊB
Pathway
Immunology/Inflammation
Metabolism
Microbiology/virology
Source data