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17-(Acetyloxy)-16-oxoandrostan-3-yl acetate
SpectraBase Compound ID 3g2kGcmWxLx
InChI InChI=1S/C23H34O5/c1-13(24)27-16-7-9-22(3)15(11-16)5-6-17-18(22)8-10-23(4)19(17)12-20(26)21(23)28-14(2)25/h15-19,21H,5-12H2,1-4H3
InChIKey FXIBWMJBQIDNKR-UHFFFAOYSA-N
Mol Weight 390.5 g/mol
Molecular Formula C23H34O5
Exact Mass 390.240624 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BRoLW9wkmgx
Name 5.ALPHA.-ANDROSTANE-3.ALPHA.,17.BETA.-DIOL-16-ONE(3.ALPHA.,17.BETA.-DI-ACETATE)
Alternate Name(s) 17-(ACETYLOXY)-16-OXOANDROSTAN-3-YL ACETATE
CAS Registry Number 49644-49-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H34O5
InChI InChI=1S/C23H34O5/c1-13(24)27-16-7-9-22(3)15(11-16)5-6-17-18(22)8-10-23(4)19(17)12-20(26)21(23)28-14(2)25/h15-19,21H,5-12H2,1-4H3
InChIKey FXIBWMJBQIDNKR-UHFFFAOYSA-N
Nominal Mass 390 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C12(C)CCC3C(CCC4CC(CCC34C)OC(C)=O)C2CC(=O)C1OC(C)=O
SPLASH splash10-00m0-2294000000-e5f0b062093322267c56
Source File Reference LMCM-38301-293R
Source of Spectrum Copyright (C) Dr. Makin, London Hospital Medical College, UK