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ALLYL-O-[2-ACETAMIDO-4-O-ACETYL-3,6-DI-O-BENZYL-2-DEOXY-BETA-D-MANNOPYRANOSYL)-(1->4)-O-(2,3,6-TRI-O-BENZYL-ALPHA-D-GLUCOPYRANOSYL]-(1->2)-3,4-DI-
SpectraBase Compound ID HXcdsU2HVwZ
InChI InChI=1S/C74H83NO16/c1-5-41-80-73-71(68(83-46-58-35-21-10-22-36-58)64(51(2)86-73)81-44-56-31-17-8-18-32-56)91-74-70(85-48-60-39-25-12-26-40-60)69(84-47-59-37-23-11-24-38-59)66(62(89-74)50-79-43-55-29-15-7-16-30-55)90-72-63(75-52(3)76)67(82-45-57-33-19-9-20-34-57)65(87-53(4)77)61(88-72)49-78-42-54-27-13-6-14-28-54/h5-40,51,61-74H,1,41-50H2,2-4H3,(H,75,76)/t51-,61-,62+,63+,64-,65-,66+,67-,68+,69-,70+,71+,72+,73+,74+/m1/s1
InChIKey JUKCERVKNPPWJC-QOPZLORRSA-N
Mol Weight 1242.5 g/mol
Molecular Formula C74H83NO16
Exact Mass 1241.571186 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GwUtDwbCBgC
Name ALLYL-O-[2-ACETAMIDO-4-O-ACETYL-3,6-DI-O-BENZYL-2-DEOXY-BETA-D-MANNOPYRANOSYL)-(1->4)-O-(2,3,6-TRI-O-BENZYL-ALPHA-D-GLUCOPYRANOSYL]-(1->2)-3,4-DI-
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C74H83NO16
InChI InChI=1S/C74H83NO16/c1-5-41-80-73-71(68(83-46-58-35-21-10-22-36-58)64(51(2)86-73)81-44-56-31-17-8-18-32-56)91-74-70(85-48-60-39-25-12-26-40-60)69(84-47-59-37-23-11-24-38-59)66(62(89-74)50-79-43-55-29-15-7-16-30-55)90-72-63(75-52(3)76)67(82-45-57-33-19-9-20-34-57)65(87-53(4)77)61(88-72)49-78-42-54-27-13-6-14-28-54/h5-40,51,61-74H,1,41-50H2,2-4H3,(H,75,76)/t51-,61-,62+,63+,64-,65-,66+,67-,68+,69-,70+,71+,72+,73+,74+/m1/s1
InChIKey JUKCERVKNPPWJC-QOPZLORRSA-N
Literature Reference Author M.NILSSON,T.NORBERG
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1699(1998)
Literature Reference DOI 10.1039/a709293h
Molecular Weight 1242.470 g/mol
Solvent CDCl3
Source File Reference UWSI7324