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3-BETA-ACETYLOXY-17-BETA-(2',5'-DIHYDRO-5'-OXO-3'-FURYL)-ANDROSTA-5,16-DIEN-7-ONE
SpectraBase Compound ID LG7Wp8DDIGt
InChI InChI=1S/C25H30O5/c1-14(26)30-17-6-8-24(2)16(11-17)12-21(27)23-19-5-4-18(15-10-22(28)29-13-15)25(19,3)9-7-20(23)24/h4,10,12,17,19-20,23H,5-9,11,13H2,1-3H3/t17-,19-,20-,23-,24-,25+/m0/s1
InChIKey ZTPASQDGFNKTPH-SDRHTPNUSA-N
Mol Weight 410.51 g/mol
Molecular Formula C25H30O5
Exact Mass 410.209324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1XrBuoOdM9A
Name 3-BETA-ACETYLOXY-17-BETA-(2',5'-DIHYDRO-5'-OXO-3'-FURYL)-ANDROSTA-5,16-DIEN-7-ONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H30O5
InChI InChI=1S/C25H30O5/c1-14(26)30-17-6-8-24(2)16(11-17)12-21(27)23-19-5-4-18(15-10-22(28)29-13-15)25(19,3)9-7-20(23)24/h4,10,12,17,19-20,23H,5-9,11,13H2,1-3H3/t17-,19-,20-,23-,24-,25+/m0/s1
InChIKey ZTPASQDGFNKTPH-SDRHTPNUSA-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 410.510 g/mol
Solvent CDCl3
Source File Reference UNIW97