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Substance Name: Sitofibrate [INN]
RN: 55902-94-8
UNII: SM0FE61T7E
InChIKey: AKGJIVJDHCUPMI-ISMOLGHHSA-N

Molecular Formula

  • C39-H59-Cl-O3

Molecular Weight

  • 611.3451
 
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Names and Synonyms

Name of Substance

  • Sitofibrate [INN]

Synonyms

  • 5-Stigmasten-3beta-yl 2-(4-chlorphenoxy)-2-methylpropionat
  • Sitofibrate
  • Sitofibrato
  • Sitofibratum
  • Stigmast-5-en-3beta-ol 2-(p-chlorophenoxy)-2-methylpropionate
  • Stigmast-5-en-3beta-ol-2-(p-chlorophenoxy)-2-methylpropionate
  • UNII-SM0FE61T7E

Registry Numbers

CAS Registry Number

  • 55902-94-8

FDA UNII

  • SM0FE61T7E

System Generated Number

  • 0055902948

Structure Descriptors

InChI

1S/C39H59ClO3/c1-9-27(25(2)3)11-10-26(4)33-18-19-34-32-17-12-28-24-31(20-22-38(28,7)35(32)21-23-39(33,34)8)42-36(41)37(5,6)43-30-15-13-29(40)14-16-30/h12-16,25-27,31-35H,9-11,17-24H2,1-8H3/t26-,27-,31+,32+,33-,34+,35+,38+,39-/m1/s1

InChIKey

AKGJIVJDHCUPMI-ISMOLGHHSA-N

Smiles

CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)C(C)(C)Oc5ccc(Cl)cc5)C(C)C