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ANDROST-5-ENE-3.BETA.,7.BETA.,17.BETA.-TRIOL(3.BETA.,7.BETA.,17.BETA.-TRI-ACETATE)
SpectraBase Compound ID AmE2WadEESw
InChI InChI=1S/C25H36O6/c1-14(26)29-18-8-10-24(4)17(12-18)13-21(30-15(2)27)23-19-6-7-22(31-16(3)28)25(19,5)11-9-20(23)24/h13,18-23H,6-12H2,1-5H3
InChIKey GJXXDUBAEHLROD-UHFFFAOYSA-N
Mol Weight 432.6 g/mol
Molecular Formula C25H36O6
Exact Mass 432.251189 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HrE7YLp8qQs
Name ANDROST-5-ENE-3.BETA.,7.BETA.,17.BETA.-TRIOL(3.BETA.,7.BETA.,17.BETA.-TRI-ACETATE)
Alternate Name(s) 3,17-BIS(ACETYLOXY)ANDROST-5-EN-7-YL ACETATE
CAS Registry Number 40474-65-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C25H36O6
InChI InChI=1S/C25H36O6/c1-14(26)29-18-8-10-24(4)17(12-18)13-21(30-15(2)27)23-19-6-7-22(31-16(3)28)25(19,5)11-9-20(23)24/h13,18-23H,6-12H2,1-5H3
InChIKey GJXXDUBAEHLROD-UHFFFAOYSA-N
Nominal Mass 432 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C12(C)CCC(CC2=CC(OC(C)=O)C2C1CCC1(C2CCC1OC(C)=O)C)OC(C)=O
SPLASH splash10-001i-1639000000-ad497d66a0ef3fbe3871
Source File Reference LMCM-18971-663G
Source of Spectrum Copyright (C) Dr. Makin, London Hospital Medical College, UK