| SpectraBase Compound ID | 8IyRaO8sLxz |
|---|---|
| InChI | InChI=1S/C41H45Cl3N4O12/c1-4-20-53-33-34(55-23-28-18-12-7-13-19-28)36(56-25(2)49)39(59-35(33)37(50)51-3)58-31-29(24-52-21-26-14-8-5-9-15-26)57-38(60-40(45)41(42,43)44)30(47-48-46)32(31)54-22-27-16-10-6-11-17-27/h4-19,29-36,38-39,45H,1,20-24H2,2-3H3/t29-,30-,31-,32-,33+,34+,35-,36-,38+,39-/m1/s1 |
| InChIKey | MXJMLLGBHRXMMP-VDUIENELSA-N |
| Mol Weight | 892.2 g/mol |
| Molecular Formula | C41H45Cl3N4O12 |
| Exact Mass | 890.209956 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GdN03mlwVgf |
|---|---|
| Name | #15;METHYL-(2-O-ACETYL-4-O-ALLYL-3-O-BENZYL-ALPHA-L-IDOPYRANOSID)-URONATE-(1->4)-2-AZIDO-3,6-DI-O-BENZYL-2-DEOXY-BETA-D-GLUCOPYRANOSIDE-TRICHLOROACETIMIDATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H45Cl3N4O12 |
| InChI | InChI=1S/C41H45Cl3N4O12/c1-4-20-53-33-34(55-23-28-18-12-7-13-19-28)36(56-25(2)49)39(59-35(33)37(50)51-3)58-31-29(24-52-21-26-14-8-5-9-15-26)57-38(60-40(45)41(42,43)44)30(47-48-46)32(31)54-22-27-16-10-6-11-17-27/h4-19,29-36,38-39,45H,1,20-24H2,2-3H3/t29-,30-,31-,32-,33+,34+,35-,36-,38+,39-/m1/s1 |
| InChIKey | MXJMLLGBHRXMMP-VDUIENELSA-N |
| Literature Reference Author | G.J.S.LOHMAN,P.H.SEEBERGER |
| Literature Reference Citation | J.ORG.CHEM.,69,4081(2004) |
| Literature Reference DOI | 10.1021/jo035732z |
| Molecular Weight | 892.187 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN21640 |