| SpectraBase Compound ID | CD9kU6kef6S |
|---|---|
| InChI | InChI=1S/C56H62Cl3NO12/c1-4-30-65-52-51(69-36-42-24-16-9-17-25-42)49(46(71-54(52)66-31-5-2)38-64-33-43-26-28-44(62-3)29-27-43)72-53-47(60-55(61)56(57,58)59)50(68-35-41-22-14-8-15-23-41)48(67-34-40-20-12-7-13-21-40)45(70-53)37-63-32-39-18-10-6-11-19-39/h4-29,45-54H,1-2,30-38H2,3H3,(H,60,61)/t45-,46-,47-,48+,49-,50-,51+,52+,53+,54+/m0/s1 |
| InChIKey | MFQKPBWYDHAJQU-SNJLDAPCSA-N |
| Mol Weight | 1047.5 g/mol |
| Molecular Formula | C56H62Cl3NO12 |
| Exact Mass | 1045.33376 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Cjvd8e8Qtdq |
|---|---|
| Name | #17;ALLYL-(3,4,6-TRI-O-BENZYL-2-DEOXY-2-TRICHLOROACETAMIDO-BETA-D-GALACTOPYRANOSYL)-(1->4)-2-O-ALLYL-3-O-BENZYL-6-O-(4-METHOXYBENZYL)-ALPHA-D-MANNOPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C56H62Cl3NO12 |
| InChI | InChI=1S/C56H62Cl3NO12/c1-4-30-65-52-51(69-36-42-24-16-9-17-25-42)49(46(71-54(52)66-31-5-2)38-64-33-43-26-28-44(62-3)29-27-43)72-53-47(60-55(61)56(57,58)59)50(68-35-41-22-14-8-15-23-41)48(67-34-40-20-12-7-13-21-40)45(70-53)37-63-32-39-18-10-6-11-19-39/h4-29,45-54H,1-2,30-38H2,3H3,(H,60,61)/t45-,46-,47-,48+,49-,50-,51+,52+,53+,54+/m0/s1 |
| InChIKey | MFQKPBWYDHAJQU-SNJLDAPCSA-N |
| Literature Reference Author | K.PEKARI,R.R.SCHMIDT |
| Literature Reference Citation | J.ORG.CHEM.,68,1295(2003) |
| Literature Reference DOI | 10.1021/jo026380j |
| Molecular Weight | 1047.467 g/mol |
| Solvent | Unknown |
| Source File Reference | UWVN25522 |