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Substance Name: Stigmastenone
RN: 4736-55-4
UNII: 85907B49EV
InChIKey: RTLUSWHIKFIQFU-DALQDKCESA-N

Molecular Formula

  • C29-H48-O

Molecular Weight

  • 412.6972
 
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Names and Synonyms

Name of Substance

  • Stigmastenone

Synonyms

  • (5beta,22E)-Stigmast-22-en-3-one
  • (5R,8R,9S,10S,13R,14S,17R)-17-((2R,5S,E)-5-Ethyl-6-methylhept-3-en-2-yl)-10,13-dimethylhexadecahydro-3H-cyclopenta(a)phenanthren-3-one
  • (5R,8R,9S,10S,13R,14S,17R)-17-((E,2R,5S)-5-Ethyl-6-methyl-hept-3-en-2-yl)-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta(a)phenanthren-3-one
  • (5R,8R,9S,10S,13R,14S,17R)-17-((E,2R,5S)-5-Ethyl-6-methylhept-3-en-2-yl)-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta(a)phenanthren-3-one
  • 24beta-Ethyl-5beta-cholest-22-en-3-one
  • 5beta-Stigmast-22-en-3-one
  • NSC-63551
  • Stigmast-22-en-3-one, (5beta,22E)-
  • Stigmastenone
  • UNII-85907B49EV

Registry Numbers

CAS Registry Number

  • 4736-55-4

FDA UNII

  • 85907B49EV

System Generated Number

  • 0004736554

Structure Descriptors

InChI

1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-9,19-22,24-27H,7,10-18H2,1-6H3/b9-8+/t20-,21-,22-,24+,25-,26+,27+,28+,29-/m1/s1

InChIKey

RTLUSWHIKFIQFU-DALQDKCESA-N

Smiles

CC[C@H](\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C