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Substance Name: Orlistat [USAN:INN:BAN]
RN: 96829-58-2
UNII: 95M8R751W8
InChIKey: AHLBNYSZXLDEJQ-FWEHEUNISA-N

Note

  • Isolated from Streptomyces toxytricini; inhibits 3C protease, viral.

Molecular Formula

  • C29-H53-N-O5

Molecular Weight

  • 495.7397
 

Classification Codes

  • Anti-Obesity Agents
  • Central Nervous System Agents
  • Enzyme Inhibitors
  • Inhibitor (Pancreatic Lipase)

Names and Synonyms

Name of Substance

  • Orlistat
  • Orlistat [USAN:INN:BAN]

Synonyms

  • (-)-Tetrahydrolipstatin
  • Alli
  • HSDB 7556
  • L-Leucine, N-formyl-, 1-((3-hexyl-4-oxo-2-oxetanyl)methyl)dodecyl ester, (2S-(2alpha(R*),3beta))-
  • N-Formyl-L-leucine, ester with (3S,4S)-3-hexyl-4-((2S)-2-hydroxytridecyl)-2-oxetanone
  • Orlipastat
  • Orlipastatum
  • Orlipastatum [INN-Latin]
  • Orlistat
  • Ro 18-0647/002
  • Tetrahydrolipstatin
  • UNII-95M8R751W8
  • Xenical

Systematic Names

  • L-Leucine, N-formyl-, (1S)-1-(((2S,3S)-3-hexyl-4-oxo-2-oxetanyl)methyl)dodecyl ester
  • L-Leucine, N-formyl-, 1-((3-hexyl-4-oxo-2-oxetanyl)methyl)dodecyl ester, (2S-(2alpha(R*),3beta))-

Registry Numbers

CAS Registry Number

  • 96829-58-2

FDA UNII

  • 95M8R751W8

Other Registry Number

  • 111397-16-1

System Generated Number

  • 0096829582

Structure Descriptors

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

InChIKey

AHLBNYSZXLDEJQ-FWEHEUNISA-N

Smiles

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