U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C12H15NO3S
Molecular Weight 253.317
Optical Activity ( - )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Thiorphan, (R)-

SMILES

OC(=O)CNC(=O)[C@H](CS)CC1=CC=CC=C1

InChI

InChIKey=LJJKNPQAGWVLDQ-JTQLQIEISA-N
InChI=1S/C12H15NO3S/c14-11(15)7-13-12(16)10(8-17)6-9-4-2-1-3-5-9/h1-5,10,17H,6-8H2,(H,13,16)(H,14,15)/t10-/m0/s1

HIDE SMILES / InChI

Molecular Formula C12H15NO3S
Molecular Weight 253.317
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Dexecadotril is powerful and selective inhibitor of neprilysin. It is anti-hypotensive agent. Dexecadotril was found to possess chemoprotective activity. It might be biologically active against multiple myeloma. It was under clinical evaluation as an intestinal antisecretatory agent.

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 20:09:02 GMT 2023
Edited
by admin
on Sat Dec 16 20:09:02 GMT 2023
Record UNII
GC7MVJ3HGZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Thiorphan, (R)-
Common Name English
LY134464
Code English
LY-134464
Code English
Glycine, N-[(2R)-2-(mercaptomethyl)-1-oxo-3-phenylpropyl]-
Systematic Name English
(-)-Thiorphan
Common Name English
N-[(2R)-2-(Mercaptomethyl)-1-oxo-3-phenylpropyl]glycine
Systematic Name English
(R)-Thiorphan
Common Name English
Thiorphan, (-)-
Common Name English
Code System Code Type Description
CAS
95908-99-9
Created by admin on Sat Dec 16 20:09:03 GMT 2023 , Edited by admin on Sat Dec 16 20:09:03 GMT 2023
PRIMARY
PUBCHEM
7059511
Created by admin on Sat Dec 16 20:09:03 GMT 2023 , Edited by admin on Sat Dec 16 20:09:03 GMT 2023
PRIMARY
FDA UNII
GC7MVJ3HGZ
Created by admin on Sat Dec 16 20:09:03 GMT 2023 , Edited by admin on Sat Dec 16 20:09:03 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER
ENANTIOMER -> ENANTIOMER
Related Record Type Details
PRODRUG -> METABOLITE ACTIVE
Related Record Type Details
ACTIVE MOIETY