Spirost-25(27)-en-12-one, 3-hydroxy-, (3β,5β)-

CAS Registry Number®

267003-21-4

CAS Name

Spirost-25(27)-en-12-one, 3-hydroxy-, (3β,5β)-

Molecular Formula

C27H40O4

Molecular Mass

428.60

Cite this Page

Spirost-25(27)-en-12-one, 3-hydroxy-, (3β,5β)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=267003-21-4 (retrieved 2024-11-23) (CAS RN: 267003-21-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H40O4/c1-15-7-10-27(30-14-15)16(2)24-22(31-27)12-21-19-6-5-17-11-18(28)8-9-25(17,3)20(19)13-23(29)26(21,24)4/h16-22,24,28H,1,5-14H2,2-4H3/t16-,17+,18-,19+,20-,21-,22-,24-,25-,26+,27+/m0/s1

InChIKey

InChIKey=NTVAFGGHUHTGEK-ZSRPSOFJSA-N

SMILES

C[C@@]12[C@@]3([C@](C[C@]1([C@]4([C@](CC2=O)([C@]5(C)[C@](CC4)(C[C@@H](O)CC5)[H])[H])[H])[H])(O[C@@]6([C@H]3C)CCC(=C)CO6)[H])[H]

Canonical SMILES

O=C1CC2C(CCC3CC(O)CCC32C)C4CC5OC6(OCC(=C)CC6)C(C)C5C14C

Other Names for this Substance

  • Spirost-25(27)-en-12-one, 3-hydroxy-, (3β,5β)-
  • Schidegeragenin B

CAS INSIGHTSTM
Hourglass and a clock