(2α,5α,17β)-17-(Acetyloxy)-2-chloroandrostan-3-one 3-[O-(4-nitrophenyl)oxime]

CAS Registry Number®

51354-31-5
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CAS Name

(2α,5α,17β)-17-(Acetyloxy)-2-chloroandrostan-3-one 3-[O-(4-nitrophenyl)oxime]

Molecular Formula

C27H35ClN2O5

Molecular Mass

503.03

Cite this Page

(2α,5α,17β)-17-(Acetyloxy)-2-chloroandrostan-3-one 3-[O-(4-nitrophenyl)oxime].   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=51354-31-5 (retrieved 2024-03-28) (CAS RN: 51354-31-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H35ClN2O5/c1-16(31)34-25-11-10-21-20-9-4-17-14-24(29-35-19-7-5-18(6-8-19)30(32)33)23(28)15-27(17,3)22(20)12-13-26(21,25)2/h5-8,17,20-23,25H,4,9-15H2,1-3H3/t17-,20-,21-,22-,23+,25-,26-,27-/m0/s1

InChIKey

InChIKey=NNFGKFKPLQYECP-JOIQTIMVSA-N

SMILES

C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@@H](OC(C)=O)CC4)[H])(CC[C@]1(CC(=NOC5=CC=C(N(=O)=O)C=C5)[C@H](Cl)C2)[H])[H])[H]

Canonical SMILES

O=C(OC1CCC2C3CCC4CC(=NOC5=CC=C(C=C5)N(=O)=O)C(Cl)CC4(C)C3CCC12C)C

Other Names for this Substance

  • Androstan-3-one, 17-(acetyloxy)-2-chloro-, 3-[O-(4-nitrophenyl)oxime], (2α,5α,17β)-
  • (2α,5α,17β)-17-(Acetyloxy)-2-chloroandrostan-3-one 3-[O-(4-nitrophenyl)oxime]
  • Nisterime acetate
  • ORF 9326

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