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#14;(1R,3R,6R,10R)-8-BENZYLOXYCARBONYL-3-PHENYL-10-[(TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-(1->3)-O-(TRI-O-ACETYL-BETA-D-GLUCOPYRANOSYL)]-OXY-8-AZA-2,4-DIOXA-B
SpectraBase Compound ID BjvM3X77M5Y
InChI InChI=1S/2C47H57NO22/c2*1-24(49)57-22-35-38(61-26(3)51)40(63-28(5)53)42(64-29(6)54)46(68-35)70-41-39(62-27(4)52)36(23-58-25(2)50)67-45(43(41)65-30(7)55)66-34-19-48(47(56)60-20-31-14-10-8-11-15-31)18-33-21-59-44(69-37(33)34)32-16-12-9-13-17-32/h2*8-17,33-46H,18-23H2,1-7H3/t2*33-,34-,35+,36+,37-,38+,39+,40-,41-,42+,43+,44-,45+,46-/m00/s1
InChIKey MGNHITABZLPFRT-WKLJZGJSSA-N
Mol Weight 1975.9 g/mol
Molecular Formula C94H114N2O44
Exact Mass 1974.674445 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9bf78kzSLK5
Name #14;(1R,3R,6R,10R)-8-BENZYLOXYCARBONYL-3-PHENYL-10-[(TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-(1->3)-O-(TRI-O-ACETYL-BETA-D-GLUCOPYRANOSYL)]-OXY-8-AZA-2,4-DIOXA-B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C94H114N2O44
InChI InChI=1S/2C47H57NO22/c2*1-24(49)57-22-35-38(61-26(3)51)40(63-28(5)53)42(64-29(6)54)46(68-35)70-41-39(62-27(4)52)36(23-58-25(2)50)67-45(43(41)65-30(7)55)66-34-19-48(47(56)60-20-31-14-10-8-11-15-31)18-33-21-59-44(69-37(33)34)32-16-12-9-13-17-32/h2*8-17,33-46H,18-23H2,1-7H3/t2*33-,34-,35+,36+,37-,38+,39+,40-,41-,42+,43+,44-,45+,46-/m00/s1
InChIKey MGNHITABZLPFRT-WKLJZGJSSA-N
Literature Reference Author J.M.MACDONALD,M.HRMOVA,G.B.FINCHER,R.V.STICK
Literature Reference Citation AUSTR.J.CHEM.,57,187(2004)
Literature Reference DOI 10.1071/CH03227
Molecular Weight 1975.926 g/mol
Solvent Unknown
Source File Reference UWVN7448