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Details

Stereochemistry ABSOLUTE
Molecular Formula C29H53NO5
Molecular Weight 495.7348
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Orlistat, (R,S,R,R)-

SMILES

CCCCCCCCCCC[C@@H](C[C@H]1OC(=O)[C@@H]1CCCCCC)OC(=O)[C@@H](CC(C)C)NC=O

InChI

InChIKey=AHLBNYSZXLDEJQ-FICKONGGSA-N
InChI=1S/C29H53NO5/c1-5-7-9-11-12-13-14-15-16-18-24(34-29(33)26(30-22-31)20-23(3)4)21-27-25(28(32)35-27)19-17-10-8-6-2/h22-27H,5-21H2,1-4H3,(H,30,31)/t24-,25+,26+,27+/m0/s1

HIDE SMILES / InChI

Molecular Formula C29H53NO5
Molecular Weight 495.7348
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:40:35 GMT 2025
Edited
by admin
on Wed Apr 02 19:40:35 GMT 2025
Record UNII
EL7S4RFH8X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(R,S,R,R)-Orlistat
Preferred Name English
Orlistat, (R,S,R,R)-
Common Name English
N-Formyl-D-leucine (1S)-1-[[(2R,3R)-3-hexyl-4-oxo-2-oxetanyl]methyl]dodecyl ester
Systematic Name English
D-Leucine, N-formyl-, (1S)-1-[[(2R,3R)-3-hexyl-4-oxo-2-oxetanyl]methyl]dodecyl ester
Systematic Name English
Orlistat (R,S,R,R)-Isomer
Common Name English
Code System Code Type Description
CAS
1620409-08-6
Created by admin on Wed Apr 02 19:40:35 GMT 2025 , Edited by admin on Wed Apr 02 19:40:35 GMT 2025
PRIMARY
PUBCHEM
46783542
Created by admin on Wed Apr 02 19:40:35 GMT 2025 , Edited by admin on Wed Apr 02 19:40:35 GMT 2025
PRIMARY
FDA UNII
EL7S4RFH8X
Created by admin on Wed Apr 02 19:40:35 GMT 2025 , Edited by admin on Wed Apr 02 19:40:35 GMT 2025
PRIMARY