CAS 96829-58-2|Orlistat

Introduction:Basic information about CAS 96829-58-2|Orlistat, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameOrlistat
CAS Number96829-58-2Molecular Weight495.735
Density1.0±0.1 g/cm3Boiling Point615.9±30.0 °C at 760 mmHg
Molecular FormulaC29H53NO5Melting Point<50ºC
MSDSChineseUSAFlash Point326.3±24.6 °C

Names

Name[(2S)-1-[(2S,3S)-3-hexyl-4-oxooxetan-2-yl]tridecan-2-yl] (2S)-2-formamido-4-methylpentanoate
SynonymMore Synonyms

Orlistat BiologicalActivity

DescriptionOrlistat is a lipase inhibitor for obesity management that acts by inhibiting the absorption of dietary fats.
Related CatalogSignaling Pathways >>Metabolic Enzyme/Protease >>Fatty Acid Synthase (FAS)Research Areas >>Metabolic Disease
References

[1]. Zhi J, et al. Review of limited systemic absorption of orlistat, a lipase inhibitor, in healthy human volunteers. J Clin Pharmacol. 1995 Nov;35(11):1103-8.

[2]. Padwal R, et al. Long-term pharmacotherapy for obesity and overweight. Cochrane Database Syst Rev. 2004;(3):CD004094.

[3]. Zhang E, et al. Glycycoumarin Sensitizes Liver Cancer Cells to ABT-737 by Targeting De Novo Lipogenesis and TOPK-Survivin Axis. Nutrients. 2018 Mar 15;10(3). pii: E353.

Chemical & Physical Properties

Density1.0±0.1 g/cm3
Boiling Point615.9±30.0 °C at 760 mmHg
Melting Point<50ºC
Molecular FormulaC29H53NO5
Molecular Weight495.735
Flash Point326.3±24.6 °C
Exact Mass495.392365
PSA81.70000
LogP8.94
Appearance of Characterssolid | white
Vapour Pressure0.0±1.8 mmHg at 25°C
Index of Refraction1.470
InChIKeyAHLBNYSZXLDEJQ-FWEHEUNISA-N
SMILESCCCCCCCCCCCC(CC1OC(=O)C1CCCCCC)OC(=O)C(CC(C)C)NC=O
Storage condition2-8°C
Water SolubilityDMSO: 19 mg/mL

Safety Information

Personal Protective EquipmentEyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
RIDADRNONH for all modes of transport
WGK Germany3
RTECSOH3167600

Articles25

More Articles
Orlistat and calcium oxalate crystalluria: an association that needs consideration.

Ren. Fail. 32(8) , 1019-21, (2010)

Obesity is currently an epidemic across the globe. Obese patients unable to achieve significant weight loss with lifestyle changes alone may require drug therapy. Clinical trials have shown that orlis...

Orlistat-induced oxalate nephropathy may be dose-independent and present as a late manifestation.

J. La. State Med. Soc. 165(5) , 283-5, (2013)

We present the case of a 61-year-old Caucasian male veteran who had been on orlistat (120mg dosing) for four years, and had changed to the over-the-counter (OTC) form, Alli (orlistat 60mg), about thre...

Mechanisms of cholesterol and saturated fatty acid lowering by Quillaja saponaria extract, studied by in vitro digestion model.

Food Funct. 6 , 1319-30, (2015)

Quillaja saponin extracts are known to reduce plasma cholesterol levels in humans. Here we study the mechanism of this effect with Quillaja Dry saponin extract (QD). In vitro model of triglyceride lip...

Synonyms

[2S-[2a(R*),3b]]-N-Formyl-L-leucine 1-[(3-hexyl-4-oxo-2-oxetanyl)methyl]dodecyl ester
(−)-Tetrahydrolipstatin
N-Formyl-L-leucine ester with (3S,4S)-3-hexyl-4-[(2S)-2-hydroxytridecyl]-2-oxetanone
(2S)-1-[(2S,3S)-3-Hexyl-4-oxo-2-oxetanyl]-2-tridecanyl N-formyl-L-leucinate
Tetrahydrolipstatin
MFCD05662360
(2S)-1-[(2S,3S)-3-Hexyl-4-oxooxetan-2-yl]tridecan-2-yl N-formyl-L-leucinate
Alli
(1S)-1-{[(2S,3S)-3-hexyl-4-oxooxetan-2-yl]methyl}dodecyl N-formyl-L-leucinate
Orlistat
(1S)-1-{[(2S,3S)-3-hexyl-4-oxooxetan-2-yl]methyl}dodecyl (2S)-2-(formylamino)-4-methylpentanoate
Orlipastat
Orlipastatum
L-Leucine, N-formyl-, (1S)-1-[[(2S,3S)-3-hexyl-4-oxo-2-oxetanyl]methyl]dodecyl ester
Xenical
(-)-Tetrahydrolipstatin
THLP
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