![#20;5-[(BENZYLOXYCARBONYL)-AMINO]-PENTYL-O-[2,3-DI-O-BENZOYL-4,6-[(S)-1-(METHOXYCARBONYL)-ETHYLIDENE]-3-O-METHYL-BETA-D-GLUCOPYRANOSYL]-(1->3)-2,4,6-TRI-O-BENZ](/api/spectrum/DqTFJS8MHox/structure.png?h=300&w=458 "#20;5-[(BENZYLOXYCARBONYL)-AMINO]-PENTYL-O-[2,3-DI-O-BENZOYL-4,6-[(S)-1-(METHOXYCARBONYL)-ETHYLIDENE]-3-O-METHYL-BETA-D-GLUCOPYRANOSYL]-(1->3)-2,4,6-TRI-O-BENZ")
| SpectraBase Compound ID | E1GGYzEIYeg |
|---|---|
| InChI | InChI=1S/C58H61NO19/c1-58(56(64)67-3)71-36-43-45(78-58)46(66-2)48(75-52(62)40-28-16-7-17-29-40)55(73-43)77-47-44(74-51(61)39-26-14-6-15-27-39)42(35-69-50(60)38-24-12-5-13-25-38)72-54(49(47)76-53(63)41-30-18-8-19-31-41)68-33-21-9-20-32-59-57(65)70-34-37-22-10-4-11-23-37/h4-8,10-19,22-31,42-49,54-55H,9,20-21,32-36H2,1-3H3,(H,59,65)/t42-,43+,44-,45+,46-,47+,48+,49-,54-,55-,58-/m1/s1 |
| InChIKey | NIMDZJJRIDBHQD-MKLOPBCTSA-N |
| Mol Weight | 1076.1 g/mol |
| Molecular Formula | C58H61NO19 |
| Exact Mass | 1075.383779 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DqTFJS8MHox |
|---|---|
| Name | #20;5-[(BENZYLOXYCARBONYL)-AMINO]-PENTYL-O-[2,3-DI-O-BENZOYL-4,6-[(S)-1-(METHOXYCARBONYL)-ETHYLIDENE]-3-O-METHYL-BETA-D-GLUCOPYRANOSYL]-(1->3)-2,4,6-TRI-O-BENZ |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C58H61NO19 |
| InChI | InChI=1S/C58H61NO19/c1-58(56(64)67-3)71-36-43-45(78-58)46(66-2)48(75-52(62)40-28-16-7-17-29-40)55(73-43)77-47-44(74-51(61)39-26-14-6-15-27-39)42(35-69-50(60)38-24-12-5-13-25-38)72-54(49(47)76-53(63)41-30-18-8-19-31-41)68-33-21-9-20-32-59-57(65)70-34-37-22-10-4-11-23-37/h4-8,10-19,22-31,42-49,54-55H,9,20-21,32-36H2,1-3H3,(H,59,65)/t42-,43+,44-,45+,46-,47+,48+,49-,54-,55-,58-/m1/s1 |
| InChIKey | NIMDZJJRIDBHQD-MKLOPBCTSA-N |
| Literature Reference Author | T.ZIEGLER,E.ECKHARDT,V.BIRAULT |
| Literature Reference Citation | J.ORG.CHEM.,58,1090(1993) |
| Literature Reference DOI | 10.1021/jo00057a021 |
| Molecular Weight | 1076.118 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS20206 |