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MYRSINIONOSIDE-E;(3S,9R/S)-MEGASTIGMAN-5-EN-3,9-DIOL-3-O-BETA-D-(6'-O-BETA-D-APIOFURANOSYL)-GLUCOPYRANOSIDE
SpectraBase Compound ID 6lmaicQnmII
InChI InChI=1S/C24H42O11/c1-12-7-14(8-23(3,4)15(12)6-5-13(2)26)34-21-19(29)18(28)17(27)16(35-21)9-32-22-20(30)24(31,10-25)11-33-22/h13-14,16-22,25-31H,5-11H2,1-4H3/t13-,14-,16+,17+,18-,19+,20-,21+,22+,24+/m1/s1
InChIKey KMKOQWRLJQCOTQ-GUJAJVKISA-N
Mol Weight 506.6 g/mol
Molecular Formula C24H42O11
Exact Mass 506.272712 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IfoQZ6ikWBu
Name MYRSINIONOSIDE-E;(3S,9R/S)-MEGASTIGMAN-5-EN-3,9-DIOL-3-O-BETA-D-(6'-O-BETA-D-APIOFURANOSYL)-GLUCOPYRANOSIDE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H42O11
InChI InChI=1S/C24H42O11/c1-12-7-14(8-23(3,4)15(12)6-5-13(2)26)34-21-19(29)18(28)17(27)16(35-21)9-32-22-20(30)24(31,10-25)11-33-22/h13-14,16-22,25-31H,5-11H2,1-4H3/t13-,14-,16+,17+,18-,19+,20-,21+,22+,24+/m1/s1
InChIKey KMKOQWRLJQCOTQ-GUJAJVKISA-N
Literature Reference Author H.OTSUKA,X.N.ZHONG,E.HIRATA,T.SHINZATO,Y.TAKEDA
Literature Reference Citation CHEM.PHARM.BULL.,49,1093(2001)
Literature Reference DOI 10.1248/cpb.49.1093
Molecular Weight 506.591 g/mol
Solvent CD3OD
Source File Reference UWVN29136