Stigmastane-3β,5α,6β-triol

CAS Registry Number®

20835-91-0

CAS Name

Stigmastane-3β,5α,6β-triol

Molecular Formula

C29H52O3

Molecular Mass

448.72

Cite this Page

Stigmastane-3β,5α,6β-triol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=20835-91-0 (retrieved 2024-11-25) (CAS RN: 20835-91-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    224-226.5 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C29H52O3/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-16-26(31)29(32)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h18-26,30-32H,7-17H2,1-6H3/t19-,20-,21+,22+,23-,24+,25+,26-,27-,28-,29+/m1/s1

InChIKey

InChIKey=VGSSUFQMXBFFTM-METNKUIYSA-N

SMILES

C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@@]([C@@H](CC[C@H](C(C)C)CC)C)(CC4)[H])[H])(C[C@@H](O)[C@@]1(O)C[C@@H](O)CC2)[H])[H]

Canonical SMILES

OC1CCC2(C)C3CCC4(C)C(CCC4C3CC(O)C2(O)C1)C(C)CCC(CC)C(C)C

Other Names for this Substance

  • Stigmastane-3,5,6-triol, (3β,5α,6β)-
  • 5α-Stigmastane-3β,5,6β-triol
  • (3β,5α,6β)-Stigmastane-3,5,6-triol
  • Stigmastane-3β,5α,6β-triol
  • 24α-Ethylcholestane-3β,5α,6β-triol

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Deleted or Replaced CAS Registry Numbers

191410-75-0

CAS INSIGHTSTM
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