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Substance Name: 11-Ketorockogenin
RN: 86023-87-2
InChIKey: DGRJLOFFNWNGJO-YKCHTTGDSA-N

Molecular Weight

  • 446.6238
 
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Names and Synonyms

Name of Substance

  • 11-Ketorockogenin

Synonym

  • NSC 96935

Systematic Name

  • Spirostan-11-one, 3,12-dihydroxy-, (3beta,5alpha,12beta,25R)-

Registry Numbers

CAS Registry Number

  • 86023-87-2

Other Registry Number

  • 90375-71-6

System Generated Number

  • 0086023872

Structure Descriptors

InChI

1S/C27H42O5/c1-14-7-10-27(31-13-14)15(2)21-20(32-27)12-19-18-6-5-16-11-17(28)8-9-25(16,3)22(18)23(29)24(30)26(19,21)4/h14-22,24,28,30H,5-13H2,1-4H3/t14-,15+,16+,17+,18+,19+,20+,21+,22-,24-,25+,26+,27-/m1/s1

InChIKey

DGRJLOFFNWNGJO-YKCHTTGDSA-N

Smiles

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