(3β,21β)-13,17-Dimethyl-A′-neo-26,28-dinorgammacer-9(11)-en-3-ol

CAS Registry Number®

5532-41-2

CAS Name

(3β,21β)-13,17-Dimethyl-A′-neo-26,28-dinorgammacer-9(11)-en-3-ol

Molecular Formula

C30H50O

Molecular Mass

426.72

Cite this Page

(3β,21β)-13,17-Dimethyl-A′-neo-26,28-dinorgammacer-9(11)-en-3-ol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=5532-41-2 (retrieved 2024-11-22) (CAS RN: 5532-41-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    298-299 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C30H50O/c1-19(2)20-9-12-24-28(20,6)17-18-29(7)22-10-11-23-26(3,4)25(31)14-15-27(23,5)21(22)13-16-30(24,29)8/h13,19-20,22-25,31H,9-12,14-18H2,1-8H3/t20-,22+,23-,24-,25-,27+,28-,29-,30+/m0/s1

InChIKey

InChIKey=VWYANPOOORUCFJ-MBVQSDBHSA-N

SMILES

C[C@@]12[C@](C)([C@]3(C(=CC1)[C@]4(C)[C@@](CC3)(C(C)(C)[C@@H](O)CC4)[H])[H])CC[C@]5(C)[C@@]2(CC[C@H]5C(C)C)[H]

Canonical SMILES

OC1CCC2(C3=CCC4(C)C5CCC(C(C)C)C5(C)CCC4(C)C3CCC2C1(C)C)C

Other Names for this Substance

  • A′-Neo-26,28-dinorgammacer-9(11)-en-3-ol, 13,17-dimethyl-, (3β,21β)-
  • Isoarborinol
  • D:C-Friedo-B′:A′-neo-8β,13β,14α,17β,18α,21αH-gammacer-9(11)-en-3β-ol
  • D:C-Friedo-B′:A′-neogammacer-9(11)-en-3-ol, (3β,8β,13β,14α,17β,18α,21β)-
  • Arborinol B

View All

Deleted or Replaced CAS Registry Numbers

90582-44-8

CAS INSIGHTSTM
Targeted protein degrader structure, illustration