| SpectraBase Compound ID | LNeb2DUL0Ln |
|---|---|
| InChI | InChI=1S/C84H85NO19/c1-56-71(92-49-59-30-14-5-15-31-59)76(78(95-52-62-36-20-8-21-37-62)83(98-56)97-53-63-44-46-67(90-3)47-45-63)104-84-77(94-51-61-34-18-7-19-35-61)75(93-50-60-32-16-6-17-33-60)73(68(100-84)54-91-48-58-28-12-4-13-29-58)103-82-70(85-57(2)86)74(102-81(89)66-42-26-11-27-43-66)72(101-80(88)65-40-24-10-25-41-65)69(99-82)55-96-79(87)64-38-22-9-23-39-64/h4-47,56,68-78,82-84H,48-55H2,1-3H3,(H,85,86)/t56-,68+,69+,70-,71-,72+,73+,74+,75-,76+,77+,78+,82-,83+,84-/m1/s1 |
| InChIKey | CEZMAULTNGWPBX-PATINHCWSA-N |
| Mol Weight | 1412.6 g/mol |
| Molecular Formula | C84H85NO19 |
| Exact Mass | 1411.57158 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HlgkkuvVzOx |
|---|---|
| Name | #11;BETA-ISOMER;METHOXYBENZYL-O-(2-ACETAMIDO-3,4,6-TRI-O-BENZOYL-2-DEOXY-BETA-D-MANNOPYRANOSYL)-(1->4)-O-(2,3,6-TRI-O-BENZYL-BETA-D-GLUCOPYRANOSYL-(1->3)-2,4-D |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C84H85NO19 |
| InChI | InChI=1S/C84H85NO19/c1-56-71(92-49-59-30-14-5-15-31-59)76(78(95-52-62-36-20-8-21-37-62)83(98-56)97-53-63-44-46-67(90-3)47-45-63)104-84-77(94-51-61-34-18-7-19-35-61)75(93-50-60-32-16-6-17-33-60)73(68(100-84)54-91-48-58-28-12-4-13-29-58)103-82-70(85-57(2)86)74(102-81(89)66-42-26-11-27-43-66)72(101-80(88)65-40-24-10-25-41-65)69(99-82)55-96-79(87)64-38-22-9-23-39-64/h4-47,56,68-78,82-84H,48-55H2,1-3H3,(H,85,86)/t56-,68+,69+,70-,71-,72+,73+,74+,75-,76+,77+,78+,82-,83+,84-/m1/s1 |
| InChIKey | CEZMAULTNGWPBX-PATINHCWSA-N |
| Literature Reference Author | E.KAJI,Y.OSA,M.TANAIKE,Y.HOSOKAWA,H.TAKAYANAGI,A.TAKADA |
| Literature Reference Citation | CHEM.PHARM.BULL.,44,437(1996) |
| Literature Reference DOI | 10.1248/cpb.44.437 |
| Molecular Weight | 1412.594 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU31452 |