(1R,3aS,3bR,5aS,7R,8aS,8bS,10aS)-1,7-Diethynylhexadecahydro-8a,10a-dimethyldicyclopenta[a,f]naphthalene-1,7-diol

CAS Registry Number®

1045-29-0

CAS Name

(1R,3aS,3bR,5aS,7R,8aS,8bS,10aS)-1,7-Diethynylhexadecahydro-8a,10a-dimethyldicyclopenta[a,f]naphthalene-1,7-diol

Molecular Formula

C22H30O2

Molecular Mass

326.47

Cite this Page

(1R,3aS,3bR,5aS,7R,8aS,8bS,10aS)-1,7-Diethynylhexadecahydro-8a,10a-dimethyldicyclopenta[a,f]naphthalene-1,7-diol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1045-29-0 (retrieved 2024-11-22) (CAS RN: 1045-29-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    169-170 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C22H30O2/c1-5-21(23)13-15-7-8-16-17(19(15,3)14-21)9-11-20(4)18(16)10-12-22(20,24)6-2/h1-2,15-18,23-24H,7-14H2,3-4H3/t15-,16+,17-,18-,19-,20-,21+,22-/m0/s1

InChIKey

InChIKey=HUUUMTTWAPMBMU-ZBJWQKIUSA-N

SMILES

C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@@](C#C)(O)CC4)[H])(CC[C@]1(C[C@@](C#C)(O)C2)[H])[H])[H]

Canonical SMILES

C#CC1(O)CC2CCC3C(CCC4(C)C3CCC4(O)C#C)C2(C)C1

Other Names for this Substance

  • Dicyclopenta[a,f]naphthalene-1,7-diol, 1,7-diethynylhexadecahydro-8a,10a-dimethyl-, (1R,3aS,3bR,5aS,7R,8aS,8bS,10aS)-
  • A-Nor-5α,17α-pregn-20-yne-2β,17-diol, 2-ethynyl-
  • A-Norpregn-20-yne-2,17-diol, 2-ethynyl-, (2β,5α,17α)-
  • (1R,3aS,3bR,5aS,7R,8aS,8bS,10aS)-1,7-Diethynylhexadecahydro-8a,10a-dimethyldicyclopenta[a,f]naphthalene-1,7-diol
  • 2α,16α-Bisethynyl-A-nor-5α-androstane-2β,16β-diol

View All

CAS INSIGHTSTM
Targeted protein degrader structure, illustration