| SpectraBase Compound ID | IRrhkvXlBfX |
|---|---|
| InChI | InChI=1S/C38H40N2O10/c1-45-37(42)31(39-36(41)30-20-12-5-13-21-30)25-49-38-33(40(43)44)35(48-24-29-18-10-4-11-19-29)34(47-23-28-16-8-3-9-17-28)32(50-38)26-46-22-27-14-6-2-7-15-27/h2-21,31-35,38H,22-26H2,1H3,(H,39,41)/t31-,32+,33+,34-,35+,38-/m0/s1 |
| InChIKey | DOPRVNGGIYQBJH-AVRJDONQSA-N |
| Mol Weight | 684.7 g/mol |
| Molecular Formula | C38H40N2O10 |
| Exact Mass | 684.268295 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9QlZOujs1Ft |
|---|---|
| Name | O-(3,4,6-TRI-O-BENZYL-2-DEOXY-2-NITRO-ALPHA-D-GALACTOPYRANOSYL)-N-(BENZOYL)-L-SERINE-METHYLESTER |
| Compound Number | 21A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H40N2O10 |
| InChI | InChI=1S/C38H40N2O10/c1-45-37(42)31(39-36(41)30-20-12-5-13-21-30)25-49-38-33(40(43)44)35(48-24-29-18-10-4-11-19-29)34(47-23-28-16-8-3-9-17-28)32(50-38)26-46-22-27-14-6-2-7-15-27/h2-21,31-35,38H,22-26H2,1H3,(H,39,41)/t31-,32+,33+,34-,35+,38-/m0/s1 |
| InChIKey | DOPRVNGGIYQBJH-AVRJDONQSA-N |
| Literature Reference Author | N.BARROCA,R.R.SCHMIDT |
| Literature Reference Citation | ORG.LETTERS,6,1551(2004) |
| Literature Reference DOI | 10.1021/ol049729t |
| Molecular Weight | 684.743 g/mol |
| Sample ID | 45769 |
| Solvent | CDCl3 |