| SpectraBase Compound ID | 1bYueZf9AQG |
|---|---|
| InChI | InChI=1S/C49H57NO13/c51-39-24-25-40(52)61-46-45(57-30-35-20-10-3-11-21-35)42(56-29-34-18-8-2-9-19-34)37(31-54-28-33-16-6-1-7-17-33)60-49(46)63-44-41(53)48(55-27-15-5-14-26-50-39)59-38-32-58-47(62-43(38)44)36-22-12-4-13-23-36/h1-4,6-13,16-23,37-38,41-49,53H,5,14-15,24-32H2,(H,50,51)/t37-,38-,41-,42+,43-,44-,45+,46-,47-,48-,49-/m0/s1 |
| InChIKey | JPRDKUYGLVMSBQ-SWQFVXAHSA-N |
| Mol Weight | 868.0 g/mol |
| Molecular Formula | C49H57NO13 |
| Exact Mass | 867.382991 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3mVWyhdkfKF |
|---|---|
| Name | 5-AMINOPENTYL-3,4,5-TRI-O-BENZYL-2-O-(3-CARBOXYPROPIONYL)-ALPHA-D-GALACTOPYRANOSYL-(1->3)-4,6-O-BENZYLIDENE-BETA-D-GLUCOPYRANOSIDE-PI-LACTAM |
| Compound Number | 7A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C49H57NO13 |
| InChI | InChI=1S/C49H57NO13/c51-39-24-25-40(52)61-46-45(57-30-35-20-10-3-11-21-35)42(56-29-34-18-8-2-9-19-34)37(31-54-28-33-16-6-1-7-17-33)60-49(46)63-44-41(53)48(55-27-15-5-14-26-50-39)59-38-32-58-47(62-43(38)44)36-22-12-4-13-23-36/h1-4,6-13,16-23,37-38,41-49,53H,5,14-15,24-32H2,(H,50,51)/t37-,38-,41-,42+,43-,44-,45+,46-,47-,48-,49-/m0/s1 |
| InChIKey | JPRDKUYGLVMSBQ-SWQFVXAHSA-N |
| Literature Reference Author | P.CLAUDE,C.LEHMANN,T.ZIEGLER |
| Literature Reference Citation | BEIL.J.ORG.CHEM.,7,1609(2011) |
| Literature Reference DOI | 10.3762/bjoc.7.189 |
| Molecular Weight | 867.990 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWBT9874 |