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Androsta-3,5-dien-17-ol, 3-(4-morpholinyl)-, acetate (ester), (17.beta.)-
SpectraBase Compound ID TGCHs3INGo
InChI InChI=1S/C25H37NO3/c1-17(27)29-23-7-6-21-20-5-4-18-16-19(26-12-14-28-15-13-26)8-10-24(18,2)22(20)9-11-25(21,23)3/h4,16,20-23H,5-15H2,1-3H3/t20?,21?,22?,23-,24-,25-/m0/s1
InChIKey LPLDNPROPZACPM-BJKDWGEJSA-N
Mol Weight 399.6 g/mol
Molecular Formula C25H37NO3
Exact Mass 399.277344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5qvpqkrZXMl
Name Androsta-3,5-dien-17-ol, 3-(4-morpholinyl)-, acetate (ester), (17.beta.)-
CAS Registry Number 84736-46-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H37NO3
InChI InChI=1S/C25H37NO3/c1-17(27)29-23-7-6-21-20-5-4-18-16-19(26-12-14-28-15-13-26)8-10-24(18,2)22(20)9-11-25(21,23)3/h4,16,20-23H,5-15H2,1-3H3/t20?,21?,22?,23-,24-,25-/m0/s1
InChIKey LPLDNPROPZACPM-BJKDWGEJSA-N
Molecular Weight 399.575 g/mol
SMILES [C@@]12(C(C=C(CC2)N2CCOCC2)=CCC2C3CC[C@@]([C@]3(CCC12)C)(OC(=O)C)[H])C
SPLASH splash10-0002-0009200000-2bface07ca3761da639e
Source of Spectrum B-35-1868-0
Synonyms (17beta)-3-(4-morpholinyl)androsta-3,5-dien-17-yl acetate 3-Morpholinoandrosta-3,5-dien-17.beta.-yl acetate
Wiley ID 1369096