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2',3',4',6'-TETRA-O-BENZOYL-BETA-D-MANNOPYRANOSYL-(1->6)-1,2,3,4-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 5A0qUMjrrQY
InChI InChI=1S/C48H46O19/c1-27(49)59-37-36(64-48(62-30(4)52)42(61-29(3)51)39(37)60-28(2)50)26-58-47-41(67-46(56)34-23-15-8-16-24-34)40(66-45(55)33-21-13-7-14-22-33)38(65-44(54)32-19-11-6-12-20-32)35(63-47)25-57-43(53)31-17-9-5-10-18-31/h5-24,35-42,47-48H,25-26H2,1-4H3/t35-,36+,37+,38-,39-,40+,41+,42+,47+,48+/m1/s1
InChIKey CYQOSFOCAGJNQV-JGPFKNQFSA-N
Mol Weight 926.9 g/mol
Molecular Formula C48H46O19
Exact Mass 926.263329 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JvP5GTpSqe2
Name 2',3',4',6'-TETRA-O-BENZOYL-BETA-D-MANNOPYRANOSYL-(1->6)-1,2,3,4-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSIDE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H46O19
InChI InChI=1S/C48H46O19/c1-27(49)59-37-36(64-48(62-30(4)52)42(61-29(3)51)39(37)60-28(2)50)26-58-47-41(67-46(56)34-23-15-8-16-24-34)40(66-45(55)33-21-13-7-14-22-33)38(65-44(54)32-19-11-6-12-20-32)35(63-47)25-57-43(53)31-17-9-5-10-18-31/h5-24,35-42,47-48H,25-26H2,1-4H3/t35-,36+,37+,38-,39-,40+,41+,42+,47+,48+/m1/s1
InChIKey CYQOSFOCAGJNQV-JGPFKNQFSA-N
Literature Reference Author E.KAJI,D.YAMAMOTO,Y.SHIRAI,K.ISHIGE,Y.ARAI,T.SHIRAHATA,K.MAK INO,T.NISHINO
Literature Reference Citation EUR.J.ORG.CHEM.,2014,3536(2014)
Literature Reference DOI 10.1002/ejoc.201402255
Molecular Weight 926.882 g/mol
Solvent CDCl3
Source File Reference UWLU85308