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ALLYL-3,6-DI-O-ACETYL-4-S-(2-ACETAMIDO-3,4,6-TRI-O-ACETYL-2-DEOXY-BETA-D-GLUCOPYRANOSYL)-2-AZIDO-2-DEOXY-4-THIO-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 1cQ625lpjsB
InChI InChI=1S/C27H38N4O14S/c1-8-9-38-26-20(30-31-28)24(43-17(7)37)25(19(44-26)11-40-14(4)34)46-27-21(29-12(2)32)23(42-16(6)36)22(41-15(5)35)18(45-27)10-39-13(3)33/h8,18-27H,1,9-11H2,2-7H3,(H,29,32)/t18-,19-,20-,21-,22-,23-,24-,25-,26-,27+/m1/s1
InChIKey BBNUTEMEBUEFHB-AZINWOCCSA-N
Mol Weight 674.7 g/mol
Molecular Formula C27H38N4O14S
Exact Mass 674.210523 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IVNNypqHpAR
Name ALLYL-3,6-DI-O-ACETYL-4-S-(2-ACETAMIDO-3,4,6-TRI-O-ACETYL-2-DEOXY-BETA-D-GLUCOPYRANOSYL)-2-AZIDO-2-DEOXY-4-THIO-BETA-D-GLUCOPYRANOSIDE
Compound Number 18-BETA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H38N4O14S
InChI InChI=1S/C27H38N4O14S/c1-8-9-38-26-20(30-31-28)24(43-17(7)37)25(19(44-26)11-40-14(4)34)46-27-21(29-12(2)32)23(42-16(6)36)22(41-15(5)35)18(45-27)10-39-13(3)33/h8,18-27H,1,9-11H2,2-7H3,(H,29,32)/t18-,19-,20-,21-,22-,23-,24-,25-,26-,27+/m1/s1
InChIKey BBNUTEMEBUEFHB-AZINWOCCSA-N
Literature Reference Author L.L.MORAIS,H.YUASA,K.BENNIS,I.RIPOCHE,F.I.AUZANNEAU
Literature Reference Citation CAN.J.CHEM.,84,587(2006)
Literature Reference DOI 10.1139/v06-043
Molecular Weight 674.677 g/mol
Sample ID 46796
Solvent CDCl3