Octyl Orlistat

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C31H57NO5
Molecular Weight	523.788
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=QYVBRBCSILZWFP-DZUOILHNSA-N

InChI=1S/C31H57NO5/c1-5-7-9-11-13-14-15-16-18-20-26(36-31(35)28(32-24-33)22-25(3)4)23-29-27(30(34)37-29)21-19-17-12-10-8-6-2/h24-29H,5-23H2,1-4H3,(H,32,33)/t26-,27-,28-,29-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C31H57NO5
Molecular Weight	523.788
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 21:08:38 GMT 2025` Edited by `admin` on `Wed Apr 02 21:08:38 GMT 2025`
Record UNII	286MYA7B7Z
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

L-Leucine, N-formyl-, (1S)-1-[[(2S,3S)-3-octyl-4-oxo-2-oxetanyl]methyl]dodecyl ester

Preferred Name

English

Octyl Orlistat

Common Name

English

N-Formyl-L-leucine (1S)-1-[[(2S,3S)-3-octyl-4-oxo-2-oxetanyl]methyl]dodecyl ester

Systematic Name

English

[(2S)-1-[(2S,3S)-3-octyl-4-oxooxetan-2-yl]tridecan-2-yl](2S)-2-formamido-4-methylpentanoate

Systematic Name

English

Code System Code Type Description

CAS

1243011-56-4

Created by admin on Wed Apr 02 21:08:38 GMT 2025 , Edited by admin on Wed Apr 02 21:08:38 GMT 2025

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EPA CompTox

DTXSID60858246

Created by admin on Wed Apr 02 21:08:38 GMT 2025 , Edited by admin on Wed Apr 02 21:08:38 GMT 2025

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PUBCHEM

71751295

Created by admin on Wed Apr 02 21:08:38 GMT 2025 , Edited by admin on Wed Apr 02 21:08:38 GMT 2025

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FDA UNII

286MYA7B7Z

Created by admin on Wed Apr 02 21:08:38 GMT 2025 , Edited by admin on Wed Apr 02 21:08:38 GMT 2025

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