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3-O-ACETYL-2,4-DI-O-(3,4,6-TRI-O-ACETYL-2-N-ALLYLOXYCARBONYLAMINO-2-DEOXY-BETA-D-GLUCOPYRANOSYL)-1,6-ANHYDRO-BETA-D-MANNOPYRANOSE
SpectraBase Compound ID FZxAvJlpTNm
InChI InChI=1S/C40H54N2O24/c1-10-12-52-39(50)41-27-32(59-21(7)47)29(57-19(5)45)24(14-54-17(3)43)62-36(27)65-31-26-16-56-38(64-26)35(34(31)61-23(9)49)66-37-28(42-40(51)53-13-11-2)33(60-22(8)48)30(58-20(6)46)25(63-37)15-55-18(4)44/h10-11,24-38H,1-2,12-16H2,3-9H3,(H,41,50)(H,42,51)/t24-,25+,26+,27-,28+,29-,30+,31+,32-,33+,34+,35-,36+,37-,38+/m1/s1
InChIKey YRYKAGFNVJPZEM-FHEPKDIZSA-N
Mol Weight 946.9 g/mol
Molecular Formula C40H54N2O24
Exact Mass 946.306651 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JclVI6a1owK
Name 3-O-ACETYL-2,4-DI-O-(3,4,6-TRI-O-ACETYL-2-N-ALLYLOXYCARBONYLAMINO-2-DEOXY-BETA-D-GLUCOPYRANOSYL)-1,6-ANHYDRO-BETA-D-MANNOPYRANOSE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H54N2O24
InChI InChI=1S/C40H54N2O24/c1-10-12-52-39(50)41-27-32(59-21(7)47)29(57-19(5)45)24(14-54-17(3)43)62-36(27)65-31-26-16-56-38(64-26)35(34(31)61-23(9)49)66-37-28(42-40(51)53-13-11-2)33(60-22(8)48)30(58-20(6)46)25(63-37)15-55-18(4)44/h10-11,24-38H,1-2,12-16H2,3-9H3,(H,41,50)(H,42,51)/t24-,25+,26+,27-,28+,29-,30+,31+,32-,33+,34+,35-,36+,37-,38+/m1/s1
InChIKey YRYKAGFNVJPZEM-FHEPKDIZSA-N
Literature Reference Author D.LAFONT,P.BOULLANGER,J.BANOUB,G.DESCOTES
Literature Reference Citation CAN.J.CHEM.,68,828(1990)
Literature Reference DOI 10.1139/v90-131
Molecular Weight 946.868 g/mol
Solvent ACETONE-D6
Source File Reference UWCS1471