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6''-o-.beta.,D-Glucopyranosyl-3''-(2''-acetoxyethyl)benzene tetraacetate
SpectraBase Compound ID 5Wja1Rf7UDU
InChI InChI=1S/C24H30O12/c1-13(25)30-11-10-18-6-8-19(9-7-18)35-24-23(34-17(5)29)22(33-16(4)28)21(32-15(3)27)20(36-24)12-31-14(2)26/h6-9,20-24H,10-12H2,1-5H3/t20-,21+,22-,23+,24+/m0/s1
InChIKey IKULECGOZUWQES-OEYYQIPYSA-N
Mol Weight 510.49 g/mol
Molecular Formula C24H30O12
Exact Mass 510.173726 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JOj5SBIDgeX
Name 6''-o-.beta.,D-Glucopyranosyl-3''-(2''-acetoxyethyl)benzene tetraacetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 510.173726394 u
Formula C24H30O12
InChI InChI=1S/C24H30O12/c1-13(25)30-11-10-18-6-8-19(9-7-18)35-24-23(34-17(5)29)22(33-16(4)28)21(32-15(3)27)20(36-24)12-31-14(2)26/h6-9,20-24H,10-12H2,1-5H3/t20-,21+,22-,23+,24+/m0/s1
InChIKey IKULECGOZUWQES-OEYYQIPYSA-N
Molecular Weight 510.492 g/mol
SMILES [C@@]1([C@]([C@](OC(=O)C)([C@@](O[C@]1(OC1=CC=C(C=C1)CCOC(=O)C)[H])(COC(=O)C)[H])[H])(OC(=O)C)[H])(OC(=O)C)[H]