Stigmasta-5,22,25-trien-3-ol, 3-acetate, (3β,22E,24S)-

CAS Registry Number®

28594-00-5

CAS Name

Stigmasta-5,22,25-trien-3-ol, 3-acetate, (3β,22E,24S)-

Molecular Formula

C31H48O2

Molecular Mass

452.71

Cite this Page

Stigmasta-5,22,25-trien-3-ol, 3-acetate, (3β,22E,24S)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=28594-00-5 (retrieved 2024-10-07) (CAS RN: 28594-00-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C31H48O2/c1-8-23(20(2)3)10-9-21(4)27-13-14-28-26-12-11-24-19-25(33-22(5)32)15-17-30(24,6)29(26)16-18-31(27,28)7/h9-11,21,23,25-29H,2,8,12-19H2,1,3-7H3/b10-9+/t21-,23+,25+,26+,27-,28+,29+,30+,31-/m1/s1

InChIKey

InChIKey=MOEVEIGHSLNJAI-RRXMTBKISA-N

SMILES

C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@@]([C@@H](/C=C/[C@@H](C(C)=C)CC)C)(CC4)[H])[H])(CC=C1C[C@@H](OC(C)=O)CC2)[H])[H]

Canonical SMILES

O=C(OC1CC2=CCC3C(CCC4(C)C(CCC34)C(C=CC(C(=C)C)CC)C)C2(C)CC1)C

Other Names for this Substance

  • Stigmasta-5,22,25-trien-3-ol, 3-acetate, (3β,22E,24S)-
  • Stigmasta-5,22,25-trien-3β-ol, acetate, (24S)-
  • Stigmasta-5,22,25-trien-3-ol, acetate, (3β,22E,24S)-
  • (24S)-Ethylcholesta-5,22,25-trien-3β-yl acetate
  • 22-Dehydroclerosteryl acetate

CAS INSIGHTSTM
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