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O-2,4,6-Tri-O-acetyl-3-deoxy-3-fluoro-bis(B-D-galactopyranosyl)-methyl-B-D-galactopyranoside hexaacetate
SpectraBase Compound ID 9M24wfcxjUz
InChI InChI=1S/C37H51FO24/c1-14(39)49-11-23-27(52-15(2)40)26(38)30(55-18(5)43)36(61-23)50-13-25-29(54-17(4)42)32(57-20(7)45)34(59-22(9)47)37(62-25)51-12-24-28(53-16(3)41)31(56-19(6)44)33(58-21(8)46)35(48-10)60-24/h23-37H,11-13H2,1-10H3/t23-,24-,25-,26?,27+,28-,29-,30-,31-,32-,33-,34-,35-,36-,37-/m1/s1
InChIKey DGVBPZJNAVKHNI-COUHVBROSA-N
Mol Weight 898.8 g/mol
Molecular Formula C37H51FO24
Exact Mass 898.275431 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1KG5QwRfV99
Name O-2,4,6-Tri-O-acetyl-3-deoxy-3-fluoro-bis(B-D-galactopyranosyl)-methyl-B-D-galactopyranoside hexaacetate
CAS Registry Number 89185-97-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C37H51FO24
InChI InChI=1S/C37H51FO24/c1-14(39)49-11-23-27(52-15(2)40)26(38)30(55-18(5)43)36(61-23)50-13-25-29(54-17(4)42)32(57-20(7)45)34(59-22(9)47)37(62-25)51-12-24-28(53-16(3)41)31(56-19(6)44)33(58-21(8)46)35(48-10)60-24/h23-37H,11-13H2,1-10H3/t23-,24-,25-,26?,27+,28-,29-,30-,31-,32-,33-,34-,35-,36-,37-/m1/s1
InChIKey DGVBPZJNAVKHNI-COUHVBROSA-N
Instrument Name Nicolet 300 M
Literature Reference T.C. Wong, V. Rutar, J.S.Wang, J. Org. Chem. 49, 4358 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O