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Methyl-2,3,4-tri-O-benzyl-6-O-(3,4,6-tri-O-benzyl-2-O-(methylsulfonyl).beta.-D-mannopyranosyl).alpha.-D-mannopyranoside
SpectraBase Compound ID 7nk7BAAECVj
InChI InChI=1S/C56H62O13S/c1-59-55-53(65-38-46-31-19-8-20-32-46)51(63-36-44-27-15-6-16-28-44)50(62-35-43-25-13-5-14-26-43)48(67-55)40-66-56-54(69-70(2,57)58)52(64-37-45-29-17-7-18-30-45)49(61-34-42-23-11-4-12-24-42)47(68-56)39-60-33-41-21-9-3-10-22-41/h3-32,47-56H,33-40H2,1-2H3/t47-,48?,49+,50?,51?,52?,53?,54+,55?,56-/m0/s1
InChIKey HYCODWNOOGTHAW-BSHSEDJOSA-N
Mol Weight 975.2 g/mol
Molecular Formula C56H62O13S
Exact Mass 974.391113 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IUzcMQ0injK
Name Methyl-2,3,4-tri-O-benzyl-6-O-(3,4,6-tri-O-benzyl-2-O-(methylsulfonyl).beta.-D-mannopyranosyl).alpha.-D-mannopyranoside
CAS Registry Number 81645-02-5#
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C56H62O13S
InChI InChI=1S/C56H62O13S/c1-59-55-53(65-38-46-31-19-8-20-32-46)51(63-36-44-27-15-6-16-28-44)50(62-35-43-25-13-5-14-26-43)48(67-55)40-66-56-54(69-70(2,57)58)52(64-37-45-29-17-7-18-30-45)49(61-34-42-23-11-4-12-24-42)47(68-56)39-60-33-41-21-9-3-10-22-41/h3-32,47-56H,33-40H2,1-2H3/t47-,48?,49+,50?,51?,52?,53?,54+,55?,56-/m0/s1
InChIKey HYCODWNOOGTHAW-BSHSEDJOSA-N
Instrument Name SF = 100 MHz
Literature Reference J. Org. Chem. 46, 1121 (1981).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3