General
Preferred name
RUTIN
Synonyms
Rutin hydrate ()
Quercetin 3-O-rutinoside ()
rutoside ()
Rutin (Rutoside) ()
Rutoside (hydrate) ()
Quercetin 3-O-rutinoside (hydrate) ()
Rutoside (trihydrate) ()
Quercetin 3-O-rutinoside (trihydrate) ()
Rutin (hydrate) ()
Rutin (trihydrate) ()
Ilixanthin ()
Yunxianggan ()
Novarrutina ()
Violaquercetrin ()
Quercetin-3-o-rutinoside ()
Paliuroside ()
Tanrutin ()
C.I. 75730 ()
NSC-9220 ()
Birutan ()
Osyritrin ()
Globulariacitrin ()
Myrticolorin ()
NSC-115918 ()
Sophorin ()
Quercetin 3-rutinoside ()
P&D ID
PD002873
CAS
153-18-4
115888-40-9
207671-50-9
250249-75-3
Tags
natural product
drug
nuisance
available
Drug indication
Discovery agent
Drug Status
investigational
approved
experimental
Max Phase
2.0
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Cell lines
2
Organisms
5
Compound Sets
17
AdooQ Bioactive Compound Library
A10815
Cayman Chemical Bioactives
19868
ChEMBL Drugs
CHEMBL226335
Drug Repurposing Hub
DrugBank
DB01698
DrugBank Approved Drugs
DB01698
DrugCentral
3535
DrugCentral Approved Drugs
3535
DrugMAP
DMEHRAJ
LSP-MoA library (Laboratory of Systems Pharmacology)
CHEMBL226335
MedChem Express Bioactive Compound Library
HY-N0148
HY-W013075
HY-N0148A
NIH Clinical Collections (NCC)
NPC Screening Collection
Nuisance compounds in cellular assays
ReFrame library
Selleckchem Bioactive Compound Library
Rutin(Rutoside)
TargetMol Bioactive Compound Library
T0795
External IDs
56
Properties
(calculated by RDKit )
Molecular Weight
610.15
Hydrogen Bond Acceptors
16
Hydrogen Bond Donors
10
Rotatable Bonds
6
Ring Count
5
Aromatic Ring Count
3
cLogP
-1.69
TPSA
269.43
Fraction CSP3
0.44
Chiral centers
10.0
Largest ring
6.0
QED
0.14
Structural alerts
1
Nonspecific/NOS
IMP
Nuisance compounds in cellular assays
Related compounds
Custom attributes
(extracted from source data)
Pathway
MAPK/ERK Pathway
Stem Cell/Wnt
PI3K/Akt/mTOR
NF-¦ÊB
Immunology/Inflammation
GPCR/G protein
Apoptosis
Autophagy
Metabolic Enzyme/Protease
Neuronal Signaling
Target
JNK
ERK
MTOR
Reactive Oxygen Species
AKR
AKR1C3
Amyloid-β
Endogenous Metabolite
ADC Cytotoxin,Immunology & Inflammation related
Indication
joint pain, nasal congestion, constipation, irritability, allergic rhinitis
Disease Area
rheumatology, otolaryngology, gastroenterology, neurology/psychiatry, allergy
MOA
antioxidant, capillary stabilizing agent, nitric oxide scavenger
Source data