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MACARANGIOSIDE-B;(7E,9R)-MEGASTIGMAN-7-EN-3-ONE-5,11-EPOXY-9-OL-9-O-(6'-O-GALLOYL)-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 1vK32sI9aN9
InChI InChI=1S/C26H34O12/c1-12(4-5-18-25(2)8-14(27)9-26(18,3)36-11-25)37-24-22(33)21(32)20(31)17(38-24)10-35-23(34)13-6-15(28)19(30)16(29)7-13/h4-7,12,17-18,20-22,24,28-33H,8-11H2,1-3H3/b5-4+/t12-,17-,18-,20-,21+,22-,24-,25-,26-/m1/s1
InChIKey LQVNYRWMNGPIEB-LJSMMZQXSA-N
Mol Weight 538.5 g/mol
Molecular Formula C26H34O12
Exact Mass 538.205027 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7vLT48DCP4o
Name MACARANGIOSIDE-B;(7E,9R)-MEGASTIGMAN-7-EN-3-ONE-5,11-EPOXY-9-OL-9-O-(6'-O-GALLOYL)-BETA-D-GLUCOPYRANOSIDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H34O12
InChI InChI=1S/C26H34O12/c1-12(4-5-18-25(2)8-14(27)9-26(18,3)36-11-25)37-24-22(33)21(32)20(31)17(38-24)10-35-23(34)13-6-15(28)19(30)16(29)7-13/h4-7,12,17-18,20-22,24,28-33H,8-11H2,1-3H3/b5-4+/t12-,17-,18-,20-,21+,22-,24-,25-,26-/m1/s1
InChIKey LQVNYRWMNGPIEB-LJSMMZQXSA-N
Literature Reference Author K.MATSUNAMI,I.TAKAMORI,T.SHINZATO,M.ARAMOTO,K.KONDO,H.OTSUKA ,Y.TAKEDA
Literature Reference Citation CHEM.PHARM.BULL.,54,1403(2006)
Literature Reference DOI 10.1248/cpb.54.1403
Molecular Weight 538.549 g/mol
Sample ID 55248
Solvent CD3OD