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DELAVINE;(22S,25S)-5-ALPHA,17-BETA-CEVANINE-3-BETA,6-BETA-DIOL
SpectraBase Compound ID Jx5c7xiVWct
InChI InChI=1S/C27H45NO2/c1-15-4-7-25-16(2)18-5-6-19-20(22(18)14-28(25)13-15)11-23-21(19)12-26(30)24-10-17(29)8-9-27(23,24)3/h15-26,29-30H,4-14H2,1-3H3/t15-,16+,17-,18-,19?,20?,21?,22+,23?,24+,25-,26+,27+/m0/s1
InChIKey NEMWYOKGHGSVSC-AQEPFVRUSA-N
Mol Weight 415.7 g/mol
Molecular Formula C27H45NO2
Exact Mass 415.34503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9SqPV3qcVFT
Name DELAVINE;(22S,25S)-5-ALPHA,17-BETA-CEVANINE-3-BETA,6-BETA-DIOL
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H45NO2
InChI InChI=1S/C27H45NO2/c1-15-4-7-25-16(2)18-5-6-19-20(22(18)14-28(25)13-15)11-23-21(19)12-26(30)24-10-17(29)8-9-27(23,24)3/h15-26,29-30H,4-14H2,1-3H3/t15-,16+,17-,18-,19?,20?,21?,22+,23?,24+,25-,26+,27+/m0/s1
InChIKey NEMWYOKGHGSVSC-AQEPFVRUSA-N
Literature Reference Author K.ORI,Y.MIMAKI,Y.SASHIDA,T.NIKAIDO,T.OHMOTO
Literature Reference Citation PHYTOCHEM.,31,3605(1992)
Literature Reference DOI 10.1016/0031-9422(92)83735-H
Molecular Weight 415.660 g/mol
Solvent CDCl3
Source File Reference UWMS27167