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Substance Name: Spirostan-3-one, 6-hydroxy-, (5alpha,6alpha,25R)-
RN: 111372-85-1
InChIKey: KALHZODBSBGPIA-UCBXDMSMSA-N

Molecular Formula

  • C27-H42-O4

Molecular Weight

  • 430.6248
 
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Names and Synonyms

Synonym

  • (22R,25R)-6alpha-Hydroxy-5alpha-spirostan-3-one

Systematic Name

  • Spirostan-3-one, 6-hydroxy-, (5alpha,6alpha,25R)-

Registry Numbers

CAS Registry Number

  • 111372-85-1

System Generated Number

  • 0111372851

Structure Descriptors

InChI

1S/C27H42O4/c1-15-5-10-27(30-14-15)16(2)24-23(31-27)13-20-18-12-22(29)21-11-17(28)6-8-25(21,3)19(18)7-9-26(20,24)4/h15-16,18-24,29H,5-14H2,1-4H3/t15-,16+,18-,19+,20+,21-,22+,23+,24+,25-,26+,27-/m1/s1

InChIKey

KALHZODBSBGPIA-UCBXDMSMSA-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]4C[C@@H]([C@@H]6[C@@]5(CCC(=O)C6)C)O)C)C)OC1