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ACTINIDIOIONOSIDE-6'-O-GALLATE;(3S,5R,6R,9R)-3,6,7,9-TETRAHYDROXY-MEGASTIGMAN-7-ENE-9-O-BETA-D-(6'-O-GALLOYL)-GLUCOPYRANOSIDE
SpectraBase Compound ID 219omTEtomI
InChI InChI=1S/C26H38O13/c1-12(5-6-26(36)24(2,3)9-14(27)10-25(26,4)35)38-23-21(33)20(32)19(31)17(39-23)11-37-22(34)13-7-15(28)18(30)16(29)8-13/h5-8,12,14,17,19-21,23,27-33,35-36H,9-11H2,1-4H3/b6-5+/t12-,14-,17-,19-,20+,21-,23-,25+,26+/m0/s1
InChIKey HYQKQEWRZPSYNA-NGJCPGAWSA-N
Mol Weight 558.6 g/mol
Molecular Formula C26H38O13
Exact Mass 558.231241 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HF0CDufKrzT
Name ACTINIDIOIONOSIDE-6'-O-GALLATE;(3S,5R,6R,9R)-3,6,7,9-TETRAHYDROXY-MEGASTIGMAN-7-ENE-9-O-BETA-D-(6'-O-GALLOYL)-GLUCOPYRANOSIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H38O13
InChI InChI=1S/C26H38O13/c1-12(5-6-26(36)24(2,3)9-14(27)10-25(26,4)35)38-23-21(33)20(32)19(31)17(39-23)11-37-22(34)13-7-15(28)18(30)16(29)8-13/h5-8,12,14,17,19-21,23,27-33,35-36H,9-11H2,1-4H3/b6-5+/t12-,14-,17-,19-,20+,21-,23-,25+,26+/m0/s1
InChIKey HYQKQEWRZPSYNA-NGJCPGAWSA-N
Literature Reference Author N.S.MAMDOUH,S.SUGIMOTO,K.MATSUNAMI,H.OTSUKA,M.S.KAMEL
Literature Reference Citation CHEM.PHARM.BULL.,62,1013(2014)
Literature Reference DOI 10.1248/cpb.c14-00352
Molecular Weight 558.580 g/mol
Solvent CD3OD
Source File Reference UWBT13947