John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=EYSu19IelzB SpectraBase Spectrum ID=4INOm14dpgu

(accessed ).
DIPSANOSIDE-E
SpectraBase Compound ID EYSu19IelzB
InChI InChI=1S/C36H52O21/c1-4-15-16(6-23-49-9-14(39)10-50-23)18(11-51-33(15)56-35-29(44)27(42)25(40)21(7-37)54-35)32(47)53-20-5-17-19(31(46)48-3)12-52-34(24(17)13(20)2)57-36-30(45)28(43)26(41)22(8-38)55-36/h4,11-17,20-30,33-45H,1,5-10H2,2-3H3/t13-,14-,15+,16-,17+,20-,21-,22-,23-,24+,25-,26-,27+,28+,29-,30-,33-,34-,35+,36+/m0/s1
InChIKey YDTGQMRUPYOHPG-CKMWCNOTSA-N
Mol Weight 820.8 g/mol
Molecular Formula C36H52O21
Exact Mass 820.300109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4INOm14dpgu
Name DIPSANOSIDE-E
Compound Number 3
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H52O21
InChI InChI=1S/C36H52O21/c1-4-15-16(6-23-49-9-14(39)10-50-23)18(11-51-33(15)56-35-29(44)27(42)25(40)21(7-37)54-35)32(47)53-20-5-17-19(31(46)48-3)12-52-34(24(17)13(20)2)57-36-30(45)28(43)26(41)22(8-38)55-36/h4,11-17,20-30,33-45H,1,5-10H2,2-3H3/t13-,14-,15+,16-,17+,20-,21-,22-,23-,24+,25-,26-,27+,28+,29-,30-,33-,34-,35+,36+/m0/s1
InChIKey YDTGQMRUPYOHPG-CKMWCNOTSA-N
Literature Reference Author X.Y.TIAN,Y.H.WANG,H.Y.LIU,S.S.YU,W.S.FANG
Literature Reference Citation CHEM.PHARM.BULL.,55,1677(2007)
Literature Reference DOI 10.1248/cpb.55.1677
Molecular Weight 820.796 g/mol
Sample ID 56005
Solvent CD3OD
SpectraBase Batch ID BfbHBBAWx0