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Substance Name: Tiprostanide [INN:BAN]
RN: 67040-53-3
UNII: W28FJ301MU
InChIKey: DRWKZQHXBXCXEO-ONNUEXRDSA-N

Molecular Formula

  • C33-H45-N-O6-S

Molecular Weight

  • 583.786
 
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Names and Synonyms

Name of Substance

  • Tiprostanide [INN:BAN]

Synonyms

  • (1S,2R,3R)-3-Hydroxy-2-((2-hydroxy-2-methylheptyl)thio)-5-oxocyclopentaneheptanoic acid, ester with 4'-hydroxybenzanilide
  • EINECS 266-556-3
  • Tiprostanida
  • Tiprostanida [Spanish]
  • Tiprostanide
  • Tiprostanidum
  • Tiprostanidum [Latin]
  • UNII-W28FJ301MU

Systematic Names

  • (1S,2R,3R)-3-Hydroxy-2-((2-hydroxy-2-methylheptyl)thio)-5-oxocyclopentaneheptanoic acid, ester with 4'-hydroxybenzanilide
  • Tiprostanide

Registry Numbers

CAS Registry Number

  • 67040-53-3

FDA UNII

  • W28FJ301MU

System Generated Number

  • 0067040533

Structure Descriptors

InChI

1S/C33H45NO6S/c1-3-4-12-21-33(2,39)23-41-31-27(28(35)22-29(31)36)15-10-5-6-11-16-30(37)40-26-19-17-25(18-20-26)34-32(38)24-13-8-7-9-14-24/h7-9,13-14,17-20,27,29,31,36,39H,3-6,10-12,15-16,21-23H2,1-2H3,(H,34,38)/t27-,29+,31+,33?/m0/s1

InChIKey

DRWKZQHXBXCXEO-ONNUEXRDSA-N

Smiles

S(C[C@@](O)(C)CCCCC)[C@@H]1[C@H](C(=O)C[C@H]1O)CCCCCCC(Oc1ccc(cc1)NC(c1ccccc1)=O)=O