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[4-O-ACETOXYMETHYL]-BENZYL-2,6-DI-O-(2,6-DIMETHYLBENZOYL)-3,4-O-ISOPROPYLIDENE-BETA-D-GALACTOPYRANOSIDE
SpectraBase Compound ID 4b5xO5jHgx0
InChI InChI=1S/C37H42O10/c1-21-10-8-11-22(2)29(21)34(39)42-20-28-31-32(47-37(6,7)46-31)33(45-35(40)30-23(3)12-9-13-24(30)4)36(44-28)43-19-27-16-14-26(15-17-27)18-41-25(5)38/h8-17,28,31-33,36H,18-20H2,1-7H3/t28-,31+,32+,33-,36-/m1/s1
InChIKey MRHZQSNZAUSLJX-DIARTVEHSA-N
Mol Weight 646.7 g/mol
Molecular Formula C37H42O10
Exact Mass 646.277798 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1nmk3k0Kmkw
Name [4-O-ACETOXYMETHYL]-BENZYL-2,6-DI-O-(2,6-DIMETHYLBENZOYL)-3,4-O-ISOPROPYLIDENE-BETA-D-GALACTOPYRANOSIDE
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H42O10
InChI InChI=1S/C37H42O10/c1-21-10-8-11-22(2)29(21)34(39)42-20-28-31-32(47-37(6,7)46-31)33(45-35(40)30-23(3)12-9-13-24(30)4)36(44-28)43-19-27-16-14-26(15-17-27)18-41-25(5)38/h8-17,28,31-33,36H,18-20H2,1-7H3/t28-,31+,32+,33-,36-/m1/s1
InChIKey MRHZQSNZAUSLJX-DIARTVEHSA-N
Literature Reference Author A.BERCES,D.M.WHITFIELD,T.NUKADA,I.Z.D.SANTOS,A.OBUCHOWSKA,J. J.KREPINSKY
Literature Reference Citation CAN.J.CHEM.,82,1157(2004)
Literature Reference DOI 10.1139/v04-059
Molecular Weight 646.734 g/mol
Solvent CDCl3
Source File Reference UWMS28682