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2,3,4,6-TETRA-O-BENZYL-D-GALACTOPYRANOSYL-ALPHA-(1->2)-1,4,5,6-TETRA-O-BENZOYL-L-CHIRO-INOSITOL
SpectraBase Compound ID 49JJSdFu1dW
InChI InChI=1S/C68H62O15/c69-55-57(79-64(70)50-33-17-5-18-34-50)60(80-65(71)51-35-19-6-20-36-51)62(82-67(73)53-39-23-8-24-40-53)61(81-66(72)52-37-21-7-22-38-52)58(55)83-68-63(77-44-49-31-15-4-16-32-49)59(76-43-48-29-13-3-14-30-48)56(75-42-47-27-11-2-12-28-47)54(78-68)45-74-41-46-25-9-1-10-26-46/h1-40,54-63,68-69H,41-45H2/t54-,55+,56+,57+,58-,59+,60+,61+,62-,63-,68-/m0/s1
InChIKey QPWQLBKKAHIDJU-ZPTPBZCMSA-N
Mol Weight 1119.2 g/mol
Molecular Formula C68H62O15
Exact Mass 1118.408871 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J452widgtJS
Name 2,3,4,6-TETRA-O-BENZYL-D-GALACTOPYRANOSYL-ALPHA-(1->2)-1,4,5,6-TETRA-O-BENZOYL-L-CHIRO-INOSITOL
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C68H62O15
InChI InChI=1S/C68H62O15/c69-55-57(79-64(70)50-33-17-5-18-34-50)60(80-65(71)51-35-19-6-20-36-51)62(82-67(73)53-39-23-8-24-40-53)61(81-66(72)52-37-21-7-22-38-52)58(55)83-68-63(77-44-49-31-15-4-16-32-49)59(76-43-48-29-13-3-14-30-48)56(75-42-47-27-11-2-12-28-47)54(78-68)45-74-41-46-25-9-1-10-26-46/h1-40,54-63,68-69H,41-45H2/t54-,55+,56+,57+,58-,59+,60+,61+,62-,63-,68-/m0/s1
InChIKey QPWQLBKKAHIDJU-ZPTPBZCMSA-N
Literature Reference Author M.B.CID,I.ALONSO,F.ALFONSO,J.B.BONILLA.J.LOPEZ-PRADOS,M.MART IN-LOMAS
Literature Reference Citation EUR.J.ORG.CHEM.,3947(2006)
Molecular Weight 1119.231 g/mol
Sample ID 44626
Solvent CDCl3