| SpectraBase Compound ID | EraEUi6jbuw |
|---|---|
| InChI | InChI=1S/C49H78N2O13/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-29-32-43(56)50-41(49(58)60-34-40-30-27-26-28-31-40)33-44(57)51-48-47(63-39(5)55)46(62-38(4)54)45(61-37(3)53)42(64-48)35-59-36(2)52/h26-28,30-31,41-42,45-48H,6-25,29,32-35H2,1-5H3,(H,50,56)(H,51,57)/t41-,42-,45+,46+,47-,48-/m0/s1 |
| InChIKey | GQXHANYLTQCLSH-PGHLHZLXSA-N |
| Mol Weight | 903.2 g/mol |
| Molecular Formula | C49H78N2O13 |
| Exact Mass | 902.550391 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | dexV0lTnxH |
|---|---|
| Name | N(4)-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL)-N(2)-TETRACOSANOYL-L-ASPARAGINE-BENZYLESTER |
| Compound Number | 17 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C49H78N2O13 |
| InChI | InChI=1S/C49H78N2O13/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-29-32-43(56)50-41(49(58)60-34-40-30-27-26-28-31-40)33-44(57)51-48-47(63-39(5)55)46(62-38(4)54)45(61-37(3)53)42(64-48)35-59-36(2)52/h26-28,30-31,41-42,45-48H,6-25,29,32-35H2,1-5H3,(H,50,56)(H,51,57)/t41-,42-,45+,46+,47-,48-/m0/s1 |
| InChIKey | GQXHANYLTQCLSH-PGHLHZLXSA-N |
| Literature Reference Author | T.VELASCO-TORRIJOS,L.ABBEY,R.O.FLAHERTY |
| Literature Reference Citation | MOLECULES,17,11346(2012) |
| Literature Reference DOI | 10.3390/molecules171011346 |
| Molecular Weight | 903.164 g/mol |
| Sample ID | 808 |
| Solvent | CDCl3 |