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(6R,7E,9R)-MEGASTIGMA-4,7-DIEN-3-ONE-9,13-DI-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID JynDYNabpp4
InChI InChI=1S/C25H40O13/c1-11(36-24-22(34)20(32)18(30)16(9-27)38-24)4-5-14-12(6-13(28)7-25(14,2)3)10-35-23-21(33)19(31)17(29)15(8-26)37-23/h4-6,11,14-24,26-27,29-34H,7-10H2,1-3H3/b5-4+/t11-,14+,15+,16-,17+,18-,19-,20+,21+,22-,23+,24-/m1/s1
InChIKey JLIUTAYKPGJIKJ-PHFNZPPWSA-N
Mol Weight 548.6 g/mol
Molecular Formula C25H40O13
Exact Mass 548.246891 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID l9YTPJLBRW
Name (6R,7E,9R)-MEGASTIGMA-4,7-DIEN-3-ONE-9,13-DI-O-BETA-D-GLUCOPYRANOSIDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H40O13
InChI InChI=1S/C25H40O13/c1-11(36-24-22(34)20(32)18(30)16(9-27)38-24)4-5-14-12(6-13(28)7-25(14,2)3)10-35-23-21(33)19(31)17(29)15(8-26)37-23/h4-6,11,14-24,26-27,29-34H,7-10H2,1-3H3/b5-4+/t11-,14+,15+,16-,17+,18-,19-,20+,21+,22-,23+,24-/m1/s1
InChIKey JLIUTAYKPGJIKJ-PHFNZPPWSA-N
Literature Reference Author M.KIKUCHI,R.KAKUDA,M.KIKUCHI,Y.YAOITA
Literature Reference Citation CHEM.PHARM.BULL.,56,610(2008)
Literature Reference DOI 10.1248/cpb.56.610
Molecular Weight 548.585 g/mol
Sample ID 1557
Solvent CD3OD