| SpectraBase Compound ID | Iqrb63zCLLt |
|---|---|
| InChI | InChI=1S/C32H49NO9S3/c1-8-43-31-29(42-26(36)16-18-32(7,44-9-2)45-10-3)28(39-20-24-14-12-11-13-15-24)27(21(4)40-31)33-30(37)25(41-23(6)35)17-19-38-22(5)34/h11-15,21,25,27-29,31H,8-10,16-20H2,1-7H3,(H,33,37)/t21-,25-,27-,28+,29+,31-/m1/s1 |
| InChIKey | HKSWZGSORPRXHS-MEDNWKSCSA-N |
| Mol Weight | 687.9 g/mol |
| Molecular Formula | C32H49NO9S3 |
| Exact Mass | 687.256946 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | YcDFNraJVw |
|---|---|
| Name | ETHYL-4-(2,4-DI-O-ACETYL-3-DEOXY-L-GLYCERO-TETRONAMIDO)-3-O-BENZYL-4,6-DIDEOXY-2-O-(4,4-DITHIOETHYL)-PENTANOYL-1-THIO-ALPHA-D-MANNOPYRANOSIDE |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H49NO9S3 |
| InChI | InChI=1S/C32H49NO9S3/c1-8-43-31-29(42-26(36)16-18-32(7,44-9-2)45-10-3)28(39-20-24-14-12-11-13-15-24)27(21(4)40-31)33-30(37)25(41-23(6)35)17-19-38-22(5)34/h11-15,21,25,27-29,31H,8-10,16-20H2,1-7H3,(H,33,37)/t21-,25-,27-,28+,29+,31-/m1/s1 |
| InChIKey | HKSWZGSORPRXHS-MEDNWKSCSA-N |
| Literature Reference Author | R.ADAMO,P.KOVAC |
| Literature Reference Citation | EUR.J.ORG.CHEM.,2803(2006) |
| Molecular Weight | 687.922 g/mol |
| Sample ID | 44071 |
| Solvent | CDCl3 |