Pregna-3,5-dien-20-one, 17-(acetyloxy)-3-(cyclopentyloxy)-

CAS Registry Number®

1178-60-5

CAS Name

Pregna-3,5-dien-20-one, 17-(acetyloxy)-3-(cyclopentyloxy)-

Molecular Formula

C28H40O4

Molecular Mass

440.61

Cite this Page

Pregna-3,5-dien-20-one, 17-(acetyloxy)-3-(cyclopentyloxy)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1178-60-5 (retrieved 2024-12-23) (CAS RN: 1178-60-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    137-138 °C

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1S/C28H40O4/c1-18(29)28(32-19(2)30)16-13-25-23-10-9-20-17-22(31-21-7-5-6-8-21)11-14-26(20,3)24(23)12-15-27(25,28)4/h9,17,21,23-25H,5-8,10-16H2,1-4H3/t23-,24+,25+,26+,27+,28+/m1/s1

InChIKey

InChIKey=NSRLWNNZHGRGJS-JVACCQEYSA-N

SMILES

C[C@@]12[C@]([C@]3([C@](CC1)([C@]4(C)C(=CC3)C=C(OC5CCCC5)CC4)[H])[H])(CC[C@]2(OC(C)=O)C(C)=O)[H]

Canonical SMILES

O=C(OC1(C(=O)C)CCC2C3CC=C4C=C(OC5CCCC5)CCC4(C)C3CCC21C)C

Other Names for this Substance

  • Pregna-3,5-dien-20-one, 17-(acetyloxy)-3-(cyclopentyloxy)-
  • Pregna-3,5-dien-20-one, 3-(cyclopentyloxy)-17-hydroxy-, acetate
  • 3-(Cyclopentyloxy)-17-hydroxypregna-3,5-dien-20-one acetate
  • Pentagestrone acetate
  • Gestovis

CAS INSIGHTSTM
Pile of blue, green, and white color of capsule pills with modern design light.