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5.ALPHA.-ANDROSTANE-1.BETA.,3.ALPHA.,6.ALPHA.-TRIOL-17-ONE(1.BETA.,3.ALPHA.,6.ALPHA.-TRI-ACETATE)
SpectraBase Compound ID H83y4MHjVzw
InChI InChI=1S/C25H36O7/c1-13(26)30-16-10-20-21(31-14(2)27)12-17-18-6-7-22(29)24(18,4)9-8-19(17)25(20,5)23(11-16)32-15(3)28/h16-21,23H,6-12H2,1-5H3
InChIKey UASNWAABUHHNQP-UHFFFAOYSA-N
Mol Weight 448.6 g/mol
Molecular Formula C25H36O7
Exact Mass 448.246103 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3jPNSt0HyOD
Name 5.ALPHA.-ANDROSTANE-1.BETA.,3.ALPHA.,6.ALPHA.-TRIOL-17-ONE(1.BETA.,3.ALPHA.,6.ALPHA.-TRI-ACETATE)
Alternate Name(s) 1,3-BIS(ACETYLOXY)-17-OXOANDROSTAN-6-YL ACETATE
CAS Registry Number 38788-50-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C25H36O7
InChI InChI=1S/C25H36O7/c1-13(26)30-16-10-20-21(31-14(2)27)12-17-18-6-7-22(29)24(18,4)9-8-19(17)25(20,5)23(11-16)32-15(3)28/h16-21,23H,6-12H2,1-5H3
InChIKey UASNWAABUHHNQP-UHFFFAOYSA-N
Nominal Mass 448 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C12(C)C(OC(C)=O)CC(CC2C(CC2C3C(C)(C(CC3)=O)CCC12)OC(C)=O)OC(C)=O
SPLASH splash10-00xr-2596000000-b6490fb3d75d0b919524
Source File Reference LMCM-77540-566E
Source of Spectrum Copyright (C) Dr. Makin, London Hospital Medical College, UK