| SpectraBase Compound ID | Ac9FbkqNTWD |
|---|---|
| InChI | InChI=1S/C40H58N4O17/c1-9-15-56-40(52)43-30(21-58-39-33(41-24(4)45)35(60-27(7)48)34(59-26(6)47)31(61-39)22-57-25(5)46)36(49)44-32(23(2)3)37(50)42-29(20-28-13-11-10-12-14-28)38(51)55-19-18-54-17-16-53-8/h9-14,23,29-35,39H,1,15-22H2,2-8H3,(H,41,45)(H,42,50)(H,43,52)(H,44,49)/t29-,30-,31-,32-,33-,34+,35-,39+/m0/s1 |
| InChIKey | HWEDYADSWDRUPI-ZUYAIYCDSA-N |
| Mol Weight | 866.9 g/mol |
| Molecular Formula | C40H58N4O17 |
| Exact Mass | 866.379696 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Bbu3KvRYfbo |
|---|---|
| Name | N-(ALLYLOXYCARBONYL)-O-(2-ACETAMIDO-3,4,6-TRI-O-ACETYL-2-DEOXY-ALPHA-D-GALACTOPYRANOSYL)-L-SERYLVALYLPHENYLALANINE-(METHOXYMETHYL)-ETHYLESTER |
| Compound Number | 15 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H58N4O17 |
| InChI | InChI=1S/C40H58N4O17/c1-9-15-56-40(52)43-30(21-58-39-33(41-24(4)45)35(60-27(7)48)34(59-26(6)47)31(61-39)22-57-25(5)46)36(49)44-32(23(2)3)37(50)42-29(20-28-13-11-10-12-14-28)38(51)55-19-18-54-17-16-53-8/h9-14,23,29-35,39H,1,15-22H2,2-8H3,(H,41,45)(H,42,50)(H,43,52)(H,44,49)/t29-,30-,31-,32-,33-,34+,35-,39+/m0/s1 |
| InChIKey | HWEDYADSWDRUPI-ZUYAIYCDSA-N |
| Literature Reference Author | J.EBERLING,P.BRAUN,D.KOWALCZYK,M.SCHULTZ,H.KUNZ |
| Literature Reference Citation | J.ORG.CHEM.,61,2638(1996) |
| Literature Reference DOI | 10.1021/jo951899j |
| Molecular Weight | 866.917 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWCS21814 |