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Substance Name: Tokorogenin
RN: 547-01-3
InChIKey: SRTGQBIWSBCVSM-JYBGDFTBSA-N

Molecular Formula

  • C27-H44-O5

Molecular Weight

  • 448.6396
 
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Names and Synonyms

Results Name

  • Tokorogenin

Synonyms

  • 1beta-Hydroxyyonogenin
  • 5beta-Spirostan-1beta,2beta,3alpha-triol, (25R)-
  • Tokorogenin

Systematic Name

  • Spirostan-1,2,3-triol, (1beta,2beta,3alpha,5beta,25R)-

Registry Numbers

CAS Registry Number

  • 547-01-3

System Generated Number

  • 0000547013

Structure Descriptors

InChI

1S/C27H44O5/c1-14-7-10-27(31-13-14)15(2)22-21(32-27)12-19-17-6-5-16-11-20(28)23(29)24(30)26(16,4)18(17)8-9-25(19,22)3/h14-24,28-30H,5-13H2,1-4H3/t14-,15+,16-,17-,18+,19+,20+,21+,22+,23-,24-,25+,26+,27?/m1/s1

InChIKey

SRTGQBIWSBCVSM-JYBGDFTBSA-N

Smiles

C[C@@H]1CCC2([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@@H]([C@@H]([C@H](C6)O)O)O)C)C)C)OC1