(11α)-17-(Acetyloxy)-9,11-epoxypregn-4-ene-3,20-dione

CAS Registry Number®

94425-51-1
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CAS Name

(11α)-17-(Acetyloxy)-9,11-epoxypregn-4-ene-3,20-dione

Molecular Formula

C23H30O5

Molecular Mass

386.48

Cite this Page

(11α)-17-(Acetyloxy)-9,11-epoxypregn-4-ene-3,20-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=94425-51-1 (retrieved 2024-05-19) (CAS RN: 94425-51-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C23H30O5/c1-13(24)22(27-14(2)25)10-8-17-18-6-5-15-11-16(26)7-9-20(15,3)23(18)19(28-23)12-21(17,22)4/h11,17-19H,5-10,12H2,1-4H3/t17-,18-,19+,20-,21-,22-,23-/m0/s1

InChIKey

InChIKey=UHRIXJLDCNOZKI-WBIUVFFSSA-N

SMILES

C[C@@]12[C@]34[C@](O3)(C[C@@]5(C)[C@]([C@@]4(CCC1=CC(=O)CC2)[H])(CC[C@]5(OC(C)=O)C(C)=O)[H])[H]

Canonical SMILES

O=C(OC1(C(=O)C)CCC2C3CCC4=CC(=O)CCC4(C)C53OC5CC21C)C

Other Names for this Substance

  • Pregn-4-ene-3,20-dione, 17-(acetyloxy)-9,11-epoxy-, (11α)-
  • (11α)-17-(Acetyloxy)-9,11-epoxypregn-4-ene-3,20-dione

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