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SCLEROSTEROID-J;19-ACETOXY-3,3-DIMETHOXY-5-ALPHA-PREGN-20-ENE
SpectraBase Compound ID 2AwY6AZPTA7
InChI InChI=1S/C25H40O4/c1-6-18-8-10-21-20-9-7-19-15-25(27-4,28-5)14-13-24(19,16-29-17(2)26)22(20)11-12-23(18,21)3/h6,18-22H,1,7-16H2,2-5H3/t18-,19-,20-,21-,22-,23+,24+/m0/s1
InChIKey ODFZDCGIBPRSKS-CLZKWMEGSA-N
Mol Weight 404.6 g/mol
Molecular Formula C25H40O4
Exact Mass 404.29266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E2qXvUEaNGS
Name SCLEROSTEROID-J;19-ACETOXY-3,3-DIMETHOXY-5-ALPHA-PREGN-20-ENE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H40O4
InChI InChI=1S/C25H40O4/c1-6-18-8-10-21-20-9-7-19-15-25(27-4,28-5)14-13-24(19,16-29-17(2)26)22(20)11-12-23(18,21)3/h6,18-22H,1,7-16H2,2-5H3/t18-,19-,20-,21-,22-,23+,24+/m0/s1
InChIKey ODFZDCGIBPRSKS-CLZKWMEGSA-N
Literature Reference Author H.Y.FANG,C.H.HSU,C.H.CHAO,Z.H.WEN,Y.C.WU,C.F.DAI,J.H.SHEU
Literature Reference Citation MAR.DRUGS,11,1853(2013)
Literature Reference DOI 10.3390/md11061853
Molecular Weight 404.590 g/mol
Source File Reference UWLU74855