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STEREONSTEROID_I;3-BETA-(BETA-XYLOPYRANOSYLOXY)-5-ALPHA-PREGNA-20-ENE
SpectraBase Compound ID jBrGdfnvdc
InChI InChI=1S/C26H42O5/c1-4-15-6-8-19-18-7-5-16-13-17(31-24-23(29)22(28)21(27)14-30-24)9-11-26(16,3)20(18)10-12-25(15,19)2/h4,15-24,27-29H,1,5-14H2,2-3H3/t15-,16-,17-,18-,19-,20-,21+,22-,23+,24-,25+,26-/m0/s1
InChIKey XOOZWHPCFPMGOC-ZAOUMRRFSA-N
Mol Weight 434.6 g/mol
Molecular Formula C26H42O5
Exact Mass 434.303224 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5CJSv57nYkP
Name STEREONSTEROID_I;3-BETA-(BETA-XYLOPYRANOSYLOXY)-5-ALPHA-PREGNA-20-ENE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H42O5
InChI InChI=1S/C26H42O5/c1-4-15-6-8-19-18-7-5-16-13-17(31-24-23(29)22(28)21(27)14-30-24)9-11-26(16,3)20(18)10-12-25(15,19)2/h4,15-24,27-29H,1,5-14H2,2-3H3/t15-,16-,17-,18-,19-,20-,21+,22-,23+,24-,25+,26-/m0/s1
InChIKey XOOZWHPCFPMGOC-ZAOUMRRFSA-N
Literature Reference Author S.K.WANG,C.F.DAI,C.Y.DUH
Literature Reference Citation J.NAT.PROD.,69,103(2006)
Literature Reference DOI 10.1021/np050384c
Molecular Weight 434.616 g/mol
Solvent PYRIDINE-D5
Source File Reference UWMZ16594