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PIPELOSIDE-A;(6R,9S)-9-HYDROXY-4-MEGASTIGMENE-9-O-BETA-D-GLUCOPYRANOSYL-(1->4)-O-BETA-D-GLUCOPYRANOSYL-(1->4)-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 5hLrinZ4RX5
InChI InChI=1S/C31H52O17/c1-12-7-14(35)8-31(3,4)15(12)6-5-13(2)43-28-24(41)21(38)26(17(10-33)45-28)48-30-25(42)22(39)27(18(11-34)46-30)47-29-23(40)20(37)19(36)16(9-32)44-29/h7,13,15-30,32-34,36-42H,5-6,8-11H2,1-4H3/t13-,15-,16+,17-,18-,19+,20-,21-,22-,23+,24-,25-,26-,27-,28-,29-,30+/m1/s1
InChIKey FCWUARFDJBCDGC-QVCMHJNZSA-N
Mol Weight 696.7 g/mol
Molecular Formula C31H52O17
Exact Mass 696.32045 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 65wYPtYIN94
Name PIPELOSIDE-A;(6R,9S)-9-HYDROXY-4-MEGASTIGMENE-9-O-BETA-D-GLUCOPYRANOSYL-(1->4)-O-BETA-D-GLUCOPYRANOSYL-(1->4)-O-BETA-D-GLUCOPYRANOSIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H52O17
InChI InChI=1S/C31H52O17/c1-12-7-14(35)8-31(3,4)15(12)6-5-13(2)43-28-24(41)21(38)26(17(10-33)45-28)48-30-25(42)22(39)27(18(11-34)46-30)47-29-23(40)20(37)19(36)16(9-32)44-29/h7,13,15-30,32-34,36-42H,5-6,8-11H2,1-4H3/t13-,15-,16+,17-,18-,19+,20-,21-,22-,23+,24-,25-,26-,27-,28-,29-,30+/m1/s1
InChIKey FCWUARFDJBCDGC-QVCMHJNZSA-N
Literature Reference Author C.MASUOKA,M.ONO,Y.ITO,M.OKAWA,T.NOHARA
Literature Reference Citation CHEM.PHARM.BULL.,50,1413(2002)
Literature Reference DOI 10.1248/cpb.50.1413
Molecular Weight 696.744 g/mol
Solvent C5D5N
Source File Reference UWMS20116