Pyrrolidinium, 1-[(5α,16β,17β)-17-(acetyloxy)-2-(4-morpholinyl)-3-oxoandrost-1-en-16-yl]-1-(2-propen-1-yl)-, bromide (1:1)

CAS Registry Number®

1190105-67-9

CAS Name

Pyrrolidinium, 1-[(5α,16β,17β)-17-(acetyloxy)-2-(4-morpholinyl)-3-oxoandrost-1-en-16-yl]-1-(2-propen-1-yl)-, bromide (1:1)

Molecular Formula

C32H49N2O4.Br

Molecular Mass

605.65

Cite this Page

Pyrrolidinium, 1-[(5α,16β,17β)-17-(acetyloxy)-2-(4-morpholinyl)-3-oxoandrost-1-en-16-yl]-1-(2-propen-1-yl)-, bromide (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1190105-67-9 (retrieved 2025-03-14) (CAS RN: 1190105-67-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C32H49N2O4.BrH/c1-5-14-34(15-6-7-16-34)28-20-26-24-9-8-23-19-29(36)27(33-12-17-37-18-13-33)21-32(23,4)25(24)10-11-31(26,3)30(28)38-22(2)35;/h5,21,23-26,28,30H,1,6-20H2,2-4H3;1H/q+1;/p-1/t23-,24+,25-,26-,28-,30-,31-,32-;/m0./s1

InChIKey

InChIKey=FDZFJGLEXRXQBW-NWTLINSMSA-M

SMILES

C(C=C)[N+]1(CCCC1)[C@@H]2[C@H](OC(C)=O)[C@]3(C)[C@@](C2)([C@]4([C@](CC3)([C@]5(C)[C@@](CC4)(CC(=O)C(=C5)N6CCOCC6)[H])[H])[H])[H].[Br-]

Canonical SMILES

[Br-].O=C(OC1C(CC2C3CCC4CC(=O)C(=CC4(C)C3CCC12C)N5CCOCC5)[N+]6(CC=C)CCCC6)C

Other Names for this Substance

  • Pyrrolidinium, 1-[(5α,16β,17β)-17-(acetyloxy)-2-(4-morpholinyl)-3-oxoandrost-1-en-16-yl]-1-(2-propen-1-yl)-, bromide (1:1)