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3-BETA,6-ALPHA-O-DIACETYL,5-ALPHA-HYDROXY-17-BETA-(2',5'-DIHYDRO-5'-OXO-3'-FURYL)-ANDROSTANE
SpectraBase Compound ID CsAathsKWZA
InChI InChI=1S/C27H38O7/c1-15(28)33-18-7-10-26(4)22-8-9-25(3)20(17-11-24(30)32-14-17)5-6-21(25)19(22)12-23(34-16(2)29)27(26,31)13-18/h11,18-23,31H,5-10,12-14H2,1-4H3/t18-,19-,20+,21-,22-,23-,25+,26+,27-/m0/s1
InChIKey JTCGZXBHNYXYIQ-CPIPMWJLSA-N
Mol Weight 474.6 g/mol
Molecular Formula C27H38O7
Exact Mass 474.261754 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID mbj3AHv4lQ
Name 17-BETA-(2',5'-DIHYDRO-5'-OXO-3'-FURYL)-5-ALPHA-ANDROSTAN-3-BETA,5,6-ALPHA-TRIOL-3,6-DIACETATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H38O7
InChI InChI=1S/C27H38O7/c1-15(28)33-18-7-10-26(4)22-8-9-25(3)20(17-11-24(30)32-14-17)5-6-21(25)19(22)12-23(34-16(2)29)27(26,31)13-18/h11,18-23,31H,5-10,12-14H2,1-4H3/t18-,19-,20+,21-,22-,23-,25+,26+,27-/m0/s1
InChIKey JTCGZXBHNYXYIQ-CPIPMWJLSA-N
Literature Reference Author J.W.BLUNT,J.B.STOTHERS
Literature Reference Citation ORG.MAGN.RES.,9,439(1977)
Literature Reference DOI 10.1002/mrc.1270090802
Molecular Weight 474.595 g/mol
Solvent CHCl3:CH3OH
Source File Reference UNIW2987