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[1,2,5]-OXADIAZOLO-[3',4':3,4]-5-BETA-PREGN-16-EN-20-ONE;HS973

Compound with spectra: 1 NMR

[1,2,5]-OXADIAZOLO-[3',4':3,4]-5-BETA-PREGN-16-EN-20-ONE;HS973
SpectraBase Compound ID 5t6yajV3ylC
InChI InChI=1S/C21H28N2O2/c1-12(24)14-6-7-15-13-4-5-17-19-18(22-25-23-19)9-11-21(17,3)16(13)8-10-20(14,15)2/h6,13,15-17H,4-5,7-11H2,1-3H3/t13-,15-,16-,17+,20+,21+/m0/s1
InChIKey CMYSLJZKPNTERP-SZRKVXSXSA-N
Mol Weight 340.47 g/mol
Molecular Formula C21H28N2O2
Exact Mass 340.215078 g/mol
Enantiomer InChIKey CMYSLJZKPNTERP-SUSQSIGFSA-N

View Spectrum of [1,2,5]-OXADIAZOLO-[3',4':3,4]-5-BETA-PREGN-16-EN-20-ONE;HS973

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
[1,2,5]-OXADIAZOLO-[3',4':3,4]-5-ALPHA-PREGN-16-EN-20-ONE;HS974
[1,2,5]-OXADIAZOLO-[3',4':3,4]-5-ALPHA-PREGN-16-EN-20-ONE-OXIME;HS998
2-(3.beta.-Acetoxyandrost-16-en-17-yl)-3,4-dihydro-2H-1-benzopyran
Androst-16-ene-16-propanoic acid, 3-(acetyloxy)-17-hydroxy-, .delta.-lactone, (3.beta.,5.alpha.)-
3-METHOXY-17-ALPHA-[3'-(2''-METHYL)-PHENYL-ISOXAZOL-5'-YL]-ESTRA-1,3,5(10),16-TETRAENE
(5R,10S,13S)-10,13-Dimethyl-2,3,4,5,6,7,8,9,10,11,12,13,14,15-tetradecahydro-1H-cyclopenta[a]phenanthrene-17-carboxylic acid[2-(1,3-dicyclo
22-Acetoxy-3.beta.-[(t-butyldimethylsilyl)oxy]-5.alpha.-23,24-bisnorchol-16-en-15-.alpha.-ol
3H-Pentaleno[2,1-a]indene-3,4,7(3aH,4aH)-trione, 3b,8,8a,8b,9,9a-hexahydro-3a,4a-dimethyl-, (3a.alpha.,3b.beta.,4a.alpha.,8a.alpha.,8b.beta.,9a.alpha.)-
Cholest-3-eno-[3,4-b]pyridine, 6'-pyrrolidin-1-yl-
Card-20(22)-enolide, 2,3-dihydroxy-15-oxo-, (2.alpha.,3.beta.,5.alpha.,14.alpha.)-
Title Journal or Book Year
A comparative structural study on the steroids [1,2,5]oxadiazolo[3′,4′:3,4]-5α-pregn-16-en-20-one oxime (HS998), [1,2,5]oxadiazolo[3′,4′:3,4]-5α-pregn-16-en-20-one (HS974), and [1,2,5]oxadiazolo[3′,4′:3,4]-5β-pregn-16-en-20-one (HS973) by NMR, molecular modeling, and X-ray investigations Steroids 1995
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