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Substance Name: 3beta,4-Dimethyl-4-aza-5alpha-cholestane
RN: 5089-86-1
UNII: D4S4VLR36T
InChIKey: GWWAUGFEXKPHIM-OXKYWHGHSA-N

Molecular Formula

  • C28-H51-N

Molecular Weight

  • 401.7179
 
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Names and Synonyms

Name of Substance

  • 3beta,4-Dimethyl-4-aza-5alpha-cholestane

Synonyms

  • 1H-Indeno(5,4-f)quinoline, 7-((1R)-1,5-dimethylhexyl)hexadecahydro-1,2,4a,6a-tetramethyl-, (2S,4aR,4bS,6aR,7R,9aS,9bS,11aR)-
  • 3beta,4-Dimethyl-4-aza-5alpha-cholestane
  • 4-Aza-5alpha-cholestane, 3beta,4-dimethyl-
  • 4-Azacholestane, 3,4-dimethyl-, (3beta,5alpha)-
  • NSC-61705
  • UNII-D4S4VLR36T

Registry Numbers

CAS Registry Number

  • 5089-86-1

FDA UNII

  • D4S4VLR36T

System Generated Number

  • 0005089861

Structure Descriptors

InChI

1S/C28H51N/c1-19(2)9-8-10-20(3)23-12-13-24-22-11-14-26-28(6,17-15-21(4)29(26)7)25(22)16-18-27(23,24)5/h19-26H,8-18H2,1-7H3/t20-,21+,22+,23-,24+,25+,26-,27-,28-/m1/s1

InChIKey

GWWAUGFEXKPHIM-OXKYWHGHSA-N

Smiles

CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4N(C)[C@@H](C)CC[C@]4(C)[C@H]3CC[C@]12C