| SpectraBase Compound ID | 3OHpuLMlNT7 |
|---|---|
| InChI | InChI=1S/C34H47NO9/c1-4-5-6-7-14-19-28(37)41-22-34(3,38)23-42-33-29(35-24(2)36)31(39-20-25-15-10-8-11-16-25)30-27(43-33)21-40-32(44-30)26-17-12-9-13-18-26/h8-13,15-18,27,29-33,38H,4-7,14,19-23H2,1-3H3,(H,35,36)/t27-,29-,30-,31-,32-,33-,34?/m0/s1 |
| InChIKey | HBUCVVUABNFCFE-SEGMWLJGSA-N |
| Mol Weight | 613.7 g/mol |
| Molecular Formula | C34H47NO9 |
| Exact Mass | 613.325082 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 38cA0tkfVgX |
|---|---|
| Name | (2S)-3-CAPRIOYLOXY-2-HYDROXY-2-METHYLPROPYL-2-ACETAMIDO-3-O-BENZYL-4,6-O-(R)-BENZYLIDENE-2-DEOXY-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 55 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H47NO9 |
| InChI | InChI=1S/C34H47NO9/c1-4-5-6-7-14-19-28(37)41-22-34(3,38)23-42-33-29(35-24(2)36)31(39-20-25-15-10-8-11-16-25)30-27(43-33)21-40-32(44-30)26-17-12-9-13-18-26/h8-13,15-18,27,29-33,38H,4-7,14,19-23H2,1-3H3,(H,35,36)/t27-,29-,30-,31-,32-,33-,34?/m0/s1 |
| InChIKey | HBUCVVUABNFCFE-SEGMWLJGSA-N |
| Literature Reference Author | J.M.VEGA-PEREZ,C.PALO-NIETO,I.PERINAN,M.VEGA-HOLM,J.M.CALDER ON-MONTANO,M.LOPEZ-L |
| Literature Reference Citation | EUR.J.ORG.CHEM.,2012,1237(2012) |
| Literature Reference DOI | 10.1002/ejoc.201101539 |
| Molecular Weight | 613.748 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWLU84994 |