(1S,2R,4aS,4bR,6aS,8S,10aS,10bS,12aS)-Octadecahydro-2,10a,12a-trimethyl-1,8-chrysenediol

CAS Registry Number®

516-51-8

CAS Name

(1S,2R,4aS,4bR,6aS,8S,10aS,10bS,12aS)-Octadecahydro-2,10a,12a-trimethyl-1,8-chrysenediol

Molecular Formula

C21H36O2

Molecular Mass

320.51

Cite this Page

(1S,2R,4aS,4bR,6aS,8S,10aS,10bS,12aS)-Octadecahydro-2,10a,12a-trimethyl-1,8-chrysenediol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=516-51-8 (retrieved 2024-11-23) (CAS RN: 516-51-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    210 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H36O2/c1-13-4-7-17-16-6-5-14-12-15(22)8-10-20(14,2)18(16)9-11-21(17,3)19(13)23/h13-19,22-23H,4-12H2,1-3H3/t13-,14+,15+,16+,17+,18+,19+,20+,21+/m1/s1

InChIKey

InChIKey=HUPSBBUECCCNKS-NHJCDZISSA-N

SMILES

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

Canonical SMILES

OC1CCC2(C)C(CCC3C4CCC(C)C(O)C4(C)CCC32)C1

Other Names for this Substance

  • 1,8-Chrysenediol, octadecahydro-2,10a,12a-trimethyl-, (1S,2R,4aS,4bR,6aS,8S,10aS,10bS,12aS)-
  • D-Homo-5α-androstane-3β,17aβ-diol, 17α-methyl-
  • D-Homoandrostane-3,17a-diol, 17-methyl-, (3β,5α,17α,17aβ)-
  • (1S,2R,4aS,4bR,6aS,8S,10aS,10bS,12aS)-Octadecahydro-2,10a,12a-trimethyl-1,8-chrysenediol
  • Uranediol

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