Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:147284 - cinanserin hydrochloride
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
cinanserin hydrochloride
ChEBI ID
CHEBI:147284
Definition
The hydrochloride salt of cinanserin. It is an inhibitor of 3C-like proteinase of severe acute respiratory syndrome coronavirus (SARS-Cov) and reduces virus replication
in vitro
.
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
more structures >>
Molfile
Formula
C20H24N2OS.ClH
Net Charge
0
Average Mass
376.940
Monoisotopic Mass
376.13761
InChI
InChI=1S/C20H24N2OS.ClH/c1-
22(2)
15-
8-
16-
24-
19-
12-
7-
6-
11-
18(19)
21-
20(23)
14-
13-
17-
9-
4-
3-
5-
10-
17;/h3-
7,9-
14H,8,15-
16H2,1-
2H3,(H,21,23)
;1H/b14-
13+;
InChIKey
LXGJPDKYMJJWRB-IERUDJENSA-N
SMILES
C=1(C=CC=CC1NC(=O)/C=C/C=2C=CC=CC2)SCCCN(C)C.Cl
Roles Classification
Biological Role
(s):
antiviral agent
A substance that destroys or inhibits replication of viruses.
EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
An EC 3.4.22.* (cysteine endopeptidase) inhibitor that interferes with the action of SARS coronavirus main proteinase (EC 3.4.22.69).
anticoronaviral agent
Any antiviral agent which inhibits the activity of coronaviruses.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
cinanserin hydrochloride (
CHEBI:147284
)
has part
cinanserin(1+) (
CHEBI:147283
)
cinanserin hydrochloride (
CHEBI:147284
)
has role
anticoronaviral agent (
CHEBI:149553
)
cinanserin hydrochloride (
CHEBI:147284
)
has role
antiviral agent (
CHEBI:22587
)
cinanserin hydrochloride (
CHEBI:147284
)
has role
EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor (
CHEBI:147285
)
cinanserin hydrochloride (
CHEBI:147284
)
is a
hydrochloride (
CHEBI:36807
)
IUPAC Name
(2
E
)-
N
-
(2-
{[3-
(dimethylamino)propyl]sulfanyl}phenyl)-
3-
phenylprop-
2-
enamide hydrochloride
Synonyms
Sources
cinanserin HCl
ChemIDplus
MAPTC
ChemIDplus
SQ 10,643
ChemIDplus
SQ 10643
ChemIDplus
Manual Xref
Database
D03506
KEGG DRUG
View more database links
Registry Number
Type
Source
54-84-2
CAS Registry Number
ChemIDplus
Citations
Types
Sources
14248340
PubMed citation
Europe PMC
14328912
PubMed citation
Europe PMC
4971651
PubMed citation
Europe PMC
5834938
PubMed citation
Europe PMC
Last Modified
23 April 2020