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Substance Name: Isosarsasapogenin, acetate
RN: 4947-75-5
InChIKey: LVRAKYNQYKVPIK-BSPYNPCNSA-N

Molecular Formula

  • C29-H46-O4

Molecular Weight

  • 458.6784
 
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Names and Synonyms

Name of Substance

  • Isosarsasapogenin, acetate

Synonyms

  • NSC 15488
  • NSC15488
  • Smilagenin acetate

Systematic Name

  • (3Beta,5beta,25R)-spirostan-3-yl acetate

Registry Numbers

CAS Registry Number

  • 4947-75-5

System Generated Number

  • 0004947755

Structure Descriptors

InChI

1S/C29H46O4/c1-17-8-13-29(31-16-17)18(2)26-25(33-29)15-24-22-7-6-20-14-21(32-19(3)30)9-11-27(20,4)23(22)10-12-28(24,26)5/h17-18,20-26H,6-16H2,1-5H3/t17-,18+,20-,21+,22-,23+,24+,25+,26+,27+,28+,29-/m1/s1

InChIKey

LVRAKYNQYKVPIK-BSPYNPCNSA-N

Smiles

C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC[C@H]6[C@@]5(CC[C@@H](C6)OC(=O)C)C)C)C)OC1