![N(4)-[2-O-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL)-ETHYL]-N(2)-TERT.-BUTOXYCARBONYL-L-ASPARAGINE-TETRADECYLAMIDE](/api/spectrum/1eyJHMgDKVI/structure.png?h=300&w=458 "N(4)-[2-O-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL)-ETHYL]-N(2)-TERT.-BUTOXYCARBONYL-L-ASPARAGINE-TETRADECYLAMIDE")
| SpectraBase Compound ID | Estob9uea4X |
|---|---|
| InChI | InChI=1S/C39H67N3O14/c1-9-10-11-12-13-14-15-16-17-18-19-20-21-41-36(48)30(42-38(49)56-39(6,7)8)24-32(47)40-22-23-50-37-35(54-29(5)46)34(53-28(4)45)33(52-27(3)44)31(55-37)25-51-26(2)43/h30-31,33-35,37H,9-25H2,1-8H3,(H,40,47)(H,41,48)(H,42,49)/t30-,31-,33+,34+,35-,37-/m0/s1 |
| InChIKey | SLURKXUBTHCFIQ-OHLDSRLVSA-N |
| Mol Weight | 802.0 g/mol |
| Molecular Formula | C39H67N3O14 |
| Exact Mass | 801.462304 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1eyJHMgDKVI |
|---|---|
| Name | N(4)-[2-O-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL)-ETHYL]-N(2)-TERT.-BUTOXYCARBONYL-L-ASPARAGINE-TETRADECYLAMIDE |
| Compound Number | 13 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H67N3O14 |
| InChI | InChI=1S/C39H67N3O14/c1-9-10-11-12-13-14-15-16-17-18-19-20-21-41-36(48)30(42-38(49)56-39(6,7)8)24-32(47)40-22-23-50-37-35(54-29(5)46)34(53-28(4)45)33(52-27(3)44)31(55-37)25-51-26(2)43/h30-31,33-35,37H,9-25H2,1-8H3,(H,40,47)(H,41,48)(H,42,49)/t30-,31-,33+,34+,35-,37-/m0/s1 |
| InChIKey | SLURKXUBTHCFIQ-OHLDSRLVSA-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 | 801.973 g/mol |
| Sample ID | 802 |
| Solvent | CDCl3 |