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5.ALPHA.-ANDROSTANE-3.BETA.,16.BETA.,18-TRIOL-6-ONE(3.BETA.,16.BETA.,18-TRI-ACETATE)
SpectraBase Compound ID 6zrG1t2I51z
InChI InChI=1S/C25H36O7/c1-14(26)30-13-25-8-6-20-19(21(25)10-18(12-25)32-16(3)28)11-23(29)22-9-17(31-15(2)27)5-7-24(20,22)4/h17-22H,5-13H2,1-4H3
InChIKey RTJSSOYRNHBHDO-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 LyLIPYYoEUN
Name 5.ALPHA.-ANDROSTANE-3.BETA.,16.BETA.,18-TRIOL-6-ONE(3.BETA.,16.BETA.,18-TRI-ACETATE)
Alternate Name(s) 16,18-BIS(ACETYLOXY)-6-OXOANDROSTAN-3-YL ACETATE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C25H36O7
InChI InChI=1S/C25H36O7/c1-14(26)30-13-25-8-6-20-19(21(25)10-18(12-25)32-16(3)28)11-23(29)22-9-17(31-15(2)27)5-7-24(20,22)4/h17-22H,5-13H2,1-4H3
InChIKey RTJSSOYRNHBHDO-UHFFFAOYSA-N
Nominal Mass 448 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C12(C)CCC(CC2C(CC2C3C(COC(C)=O)(CC(OC(C)=O)C3)CCC12)=O)OC(C)=O
SPLASH splash10-016r-8898000000-a1de56c2448740d5a8c1
Source File Reference LMCM-38552-646R
Source of Spectrum Copyright (C) Dr. Makin, London Hospital Medical College, UK