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Substance Name: Allocholanic acid
RN: 468-98-4
UNII: 0NP5R208EW
InChIKey: RPKLZQLYODPWTM-NIRKWIOJSA-N

Molecular Formula

  • C24-H40-O2

Molecular Weight

  • 360.578
 
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Names and Synonyms

Results Name

  • Allocholanic acid

Name of Substance

  • Cholanic acid, (5alpha)-

Synonyms

  • 5alpha-Cholan-24-oic acid
  • 5alpha-Cholanic acid
  • Allocholanic acid
  • Allocholanoic acid
  • Cholan-24-oic acid, (5alpha)-
  • Cholanic acid, (5alpha)-
  • Cholanic acid, 5alpha-
  • UNII-0NP5R208EW

Registry Numbers

CAS Registry Number

  • 468-98-4

FDA UNII

  • 0NP5R208EW

System Generated Number

  • 0000468984

Structure Descriptors

InChI

1S/C24H40O2/c1-16(7-12-22(25)26)19-10-11-20-18-9-8-17-6-4-5-14-23(17,2)21(18)13-15-24(19,20)3/h16-21H,4-15H2,1-3H3,(H,25,26)/t16-,17-,18+,19-,20+,21+,23+,24-/m1/s1

InChIKey

RPKLZQLYODPWTM-NIRKWIOJSA-N

Smiles

C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCCC4)C)C