(3β)-17-(Acetyloxy)-3-hydroxypregn-5-en-20-one

CAS Registry Number®

2381-45-5

CAS Name

(3β)-17-(Acetyloxy)-3-hydroxypregn-5-en-20-one

Molecular Formula

C23H34O4

Molecular Mass

374.51

Cite this Page

(3β)-17-(Acetyloxy)-3-hydroxypregn-5-en-20-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2381-45-5 (retrieved 2024-11-22) (CAS RN: 2381-45-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    218-219 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C23H34O4/c1-14(24)23(27-15(2)25)12-9-20-18-6-5-16-13-17(26)7-10-21(16,3)19(18)8-11-22(20,23)4/h5,17-20,26H,6-13H2,1-4H3/t17-,18+,19-,20-,21-,22-,23-/m0/s1

InChIKey

InChIKey=KRBMZSYRIJAAMS-KIYFCUGLSA-N

SMILES

O(C(C)=O)[C@@]1(C(C)=O)[C@]2(C)[C@@](CC1)([C@]3([C@](CC2)([C@]4(C)C(=CC3)C[C@@H](O)CC4)[H])[H])[H]

Canonical SMILES

O=C(OC1(C(=O)C)CCC2C3CC=C4CC(O)CCC4(C)C3CCC21C)C

Other Names for this Substance

  • Pregn-5-en-20-one, 17-(acetyloxy)-3-hydroxy-, (3β)-
  • Pregn-5-en-20-one, 3β,17-dihydroxy-, 17-acetate
  • (3β)-17-(Acetyloxy)-3-hydroxypregn-5-en-20-one
  • 17-Acetoxy-3β-hydroxypregn-5-en-20-one
  • 17α-Acetoxypregnenolone

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration