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Substance Name: Gitogenin diacetate
RN: 3399-20-0
UNII: WP1666Z328
InChIKey: DKNKURXYEOJDRI-UHNDFYHCSA-N

Molecular Formula

  • C31-H48-O6

Molecular Weight

  • 516.7142
 
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Names and Synonyms

Name of Substance

  • Gitogenin diacetate

Synonyms

  • 5alpha-Spirostan-2alpha,3beta-diol, diacetate, (25R)-
  • Gitogenin diacetate
  • Gitogenin diacetate [MI]
  • Spirostan-2,3-diol, diacetate, (2alpha,3beta,5alpha,25R)-
  • UNII-WP1666Z328

Registry Numbers

CAS Registry Number

  • 3399-20-0

FDA UNII

  • WP1666Z328

System Generated Number

  • 0003399200

Structure Descriptors

InChI

1S/C31H48O6/c1-17-9-12-31(34-16-17)18(2)28-26(37-31)14-24-22-8-7-21-13-25(35-19(3)32)27(36-20(4)33)15-30(21,6)23(22)10-11-29(24,28)5/h17-18,21-28H,7-16H2,1-6H3/t17-,18+,21+,22-,23+,24+,25-,26+,27-,28+,29+,30+,31-/m1/s1

InChIKey

DKNKURXYEOJDRI-UHNDFYHCSA-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(C[C@H]([C@@H](C6)OC(=O)C)OC(=O)C)C)C)C)OC1