| SpectraBase Compound ID | EQSzTHeo9F2 |
|---|---|
| InChI | InChI=1S/C68H75N3O18/c1-44-55(85-63(73)48-31-17-7-18-32-48)60(86-64(74)49-33-19-8-20-34-49)61(76-3)67(82-44)89-62-59(80-41-47-29-15-6-16-30-47)56(79-40-46-27-13-5-14-28-46)51(42-77-39-45-25-11-4-12-26-45)84-68(62)88-58-54(70-71-69)66(78-38-24-10-23-37-53(72)75-2)83-52-43-81-65(87-57(52)58)50-35-21-9-22-36-50/h4-9,11-22,25-36,44,51-52,54-62,65-68H,10,23-24,37-43H2,1-3H3/t44-,51-,52+,54+,55+,56+,57-,58+,59+,60+,61-,62-,65-,66-,67-,68+/m1/s1 |
| InChIKey | LHYNSPJWTSMXGH-CRLJHZMCSA-N |
| Mol Weight | 1222.4 g/mol |
| Molecular Formula | C68H75N3O18 |
| Exact Mass | 1221.504563 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9IUURSv9KK2 |
|---|---|
| Name | #21;5-(METHOXYCARBONYL)-PENTYL-3,4-DI-O-BENZOYL-2-O-METHYL-ALPHA-L-FUCOPYRANOSYL-(1->2)-3,4,6-TRI-O-BENZYL-BETA-D-GALACTOPYRANOSYL-(1->3)-2-AZIDE-4,6-O-BENZYLI |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C68H75N3O18 |
| InChI | InChI=1S/C68H75N3O18/c1-44-55(85-63(73)48-31-17-7-18-32-48)60(86-64(74)49-33-19-8-20-34-49)61(76-3)67(82-44)89-62-59(80-41-47-29-15-6-16-30-47)56(79-40-46-27-13-5-14-28-46)51(42-77-39-45-25-11-4-12-26-45)84-68(62)88-58-54(70-71-69)66(78-38-24-10-23-37-53(72)75-2)83-52-43-81-65(87-57(52)58)50-35-21-9-22-36-50/h4-9,11-22,25-36,44,51-52,54-62,65-68H,10,23-24,37-43H2,1-3H3/t44-,51-,52+,54+,55+,56+,57-,58+,59+,60+,61-,62-,65-,66-,67-,68+/m1/s1 |
| InChIKey | LHYNSPJWTSMXGH-CRLJHZMCSA-N |
| Literature Reference Author | A.KOIZUMI,K.YAMANO,T.TSUCHIYA,F.SCHWEIZER,F.KIUCHI,N.HADA |
| Literature Reference Citation | MOLECULES,17,9023(2012) |
| Literature Reference DOI | 10.3390/molecules17089023 |
| Molecular Weight | 1222.353 g/mol |
| Sample ID | 1329 |
| Solvent | CDCl3 |