| SpectraBase Compound ID | 50qZSceWz3L |
|---|---|
| InChI | InChI=1S/C28H42O13/c1-6-17-18(12-21(30)38-11-10-15(2)8-7-9-16(3)25(34)36-4)19(26(35)37-5)14-39-27(17)41-28-24(33)23(32)22(31)20(13-29)40-28/h6,9,14-15,18,20,22-24,27-29,31-33H,7-8,10-13H2,1-5H3/b16-9+,17-6+/t15?,18-,20-,22-,23+,24-,27-,28+/m0/s1 |
| InChIKey | VYSRUXUCKHZWFA-VTQUGELTSA-N |
| Mol Weight | 586.6 g/mol |
| Molecular Formula | C28H42O13 |
| Exact Mass | 586.262541 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6BbXODsWVxd |
|---|---|
| Name | VYSRUXUCKHZWFA-VTQUGELTSA-N |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H42O13 |
| InChI | InChI=1S/C28H42O13/c1-6-17-18(12-21(30)38-11-10-15(2)8-7-9-16(3)25(34)36-4)19(26(35)37-5)14-39-27(17)41-28-24(33)23(32)22(31)20(13-29)40-28/h6,9,14-15,18,20,22-24,27-29,31-33H,7-8,10-13H2,1-5H3/b16-9+,17-6+/t15?,18-,20-,22-,23+,24-,27-,28+/m0/s1 |
| InChIKey | VYSRUXUCKHZWFA-VTQUGELTSA-N |
| Literature Reference Author | Y.TAKENAKA,T.TANAHASHI,N.NAGAKURA |
| Literature Reference Citation | CHEM.PHARM.BULL.,46,1776(1998) |
| Literature Reference DOI | 10.1248/cpb.46.1776 |
| Molecular Weight | 586.634 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMS20858 |