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(-)-CENTROLOBOL-DIGLYCOSIDE;(3R)-1,7-BIS-(4-DIHYDROXYPHENYL)-3-HEPTANOL-3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-BETA-D-XYLOPYRANOSIDE

View entire compound with spectra: 2 NMR

(-)-CENTROLOBOL-DIGLYCOSIDE;(3R)-1,7-BIS-(4-DIHYDROXYPHENYL)-3-HEPTANOL-3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-BETA-D-XYLOPYRANOSIDE
SpectraBase Compound ID 4lPIdUkaeBU
InChI InChI=1S/C30H42O12/c31-15-23-24(35)25(36)26(37)30(41-23)42-28-22(34)16-39-29(27(28)38)40-21(14-9-18-7-12-20(33)13-8-18)4-2-1-3-17-5-10-19(32)11-6-17/h5-8,10-13,21-38H,1-4,9,14-16H2/t21-,22-,23-,24-,25+,26-,27-,28+,29+,30+/m1/s1
InChIKey KZWOSKWFOWFHDX-IYZXZOGHSA-N
Mol Weight 594.7 g/mol
Molecular Formula C30H42O12
Exact Mass 594.267627 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EmziECbWc5l
Name (-)-CENTROLOBOL-DIGLYCOSIDE;(3R)-1,7-BIS-(4-DIHYDROXYPHENYL)-3-HEPTANOL-3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-BETA-D-XYLOPYRANOSIDE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H42O12
InChI InChI=1S/C30H42O12/c31-15-23-24(35)25(36)26(37)30(41-23)42-28-22(34)16-39-29(27(28)38)40-21(14-9-18-7-12-20(33)13-8-18)4-2-1-3-17-5-10-19(32)11-6-17/h5-8,10-13,21-38H,1-4,9,14-16H2/t21-,22-,23-,24-,25+,26-,27-,28+,29+,30+/m1/s1
InChIKey KZWOSKWFOWFHDX-IYZXZOGHSA-N
Literature Reference Author D.PARK,H.J.KIM,S.Y.JUNG,C.S.YOOK,C.JIN,Y.S.LEE
Literature Reference Citation CHEM.PHARM.BULL.,58,238(2010)
Literature Reference DOI 10.1248/cpb.58.238
Molecular Weight 594.656 g/mol
Sample ID 3340
Solvent CD3OD