| SpectraBase Compound ID | BzkoyTLHljl |
|---|---|
| InChI | InChI=1S/C56H65N3O18/c1-7-28-66-43-44(68-31-37-24-16-10-17-25-37)49(70-34(2)60)54(74-47(43)51(61)63-5)72-41-39(33-65-29-35-20-12-8-13-21-35)71-53(40(58-59-57)42(41)67-30-36-22-14-9-15-23-36)73-46-45(69-32-38-26-18-11-19-27-38)50-55(77-56(3,4)76-50)75-48(46)52(62)64-6/h7-27,39-50,53-55H,1,28-33H2,2-6H3/t39-,40-,41-,42-,43-,44-,45+,46+,47+,48-,49+,50-,53-,54+,55-/m0/s1 |
| InChIKey | XTPRUJFHARSDDW-XGHUGYHCSA-N |
| Mol Weight | 1068.1 g/mol |
| Molecular Formula | C56H65N3O18 |
| Exact Mass | 1067.426312 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EQba7qOrDn1 |
|---|---|
| Name | #16;METHYL-[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-ALPHA-D-GLUCOPYRANOSIDE-(1->4)-3-O-BEN |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C56H65N3O18 |
| InChI | InChI=1S/C56H65N3O18/c1-7-28-66-43-44(68-31-37-24-16-10-17-25-37)49(70-34(2)60)54(74-47(43)51(61)63-5)72-41-39(33-65-29-35-20-12-8-13-21-35)71-53(40(58-59-57)42(41)67-30-36-22-14-9-15-23-36)73-46-45(69-32-38-26-18-11-19-27-38)50-55(77-56(3,4)76-50)75-48(46)52(62)64-6/h7-27,39-50,53-55H,1,28-33H2,2-6H3/t39-,40-,41-,42-,43-,44-,45+,46+,47+,48-,49+,50-,53-,54+,55-/m0/s1 |
| InChIKey | XTPRUJFHARSDDW-XGHUGYHCSA-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 | 1068.141 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN21641 |