| SpectraBase Compound ID | 9ysbX35bEUr |
|---|---|
| InChI | InChI=1S/C28H38O13/c1-35-17-6-13(7-18(36-2)22(17)30)5-15-11-39-27(14-8-19(37-3)23(31)20(9-14)38-4)16(15)12-40-28-26(34)25(33)24(32)21(10-29)41-28/h6-9,15-16,21,24-34H,5,10-12H2,1-4H3/t15-,16-,21+,24+,25-,26+,27+,28+/m0/s1 |
| InChIKey | HIFLTWHGASFARX-CIBVIZDISA-N |
| Mol Weight | 582.6 g/mol |
| Molecular Formula | C28H38O13 |
| Exact Mass | 582.231241 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KTIeb2lbKP5 |
|---|---|
| Name | ALANGILIGNOSIDE-C |
| Compound Number | 12 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H38O13 |
| InChI | InChI=1S/C28H38O13/c1-35-17-6-13(7-18(36-2)22(17)30)5-15-11-39-27(14-8-19(37-3)23(31)20(9-14)38-4)16(15)12-40-28-26(34)25(33)24(32)21(10-29)41-28/h6-9,15-16,21,24-34H,5,10-12H2,1-4H3/t15-,16-,21+,24+,25-,26+,27+,28+/m0/s1 |
| InChIKey | HIFLTWHGASFARX-CIBVIZDISA-N |
| Literature Reference Author | F.D.C.L.PINTO,M.D.C.M.TORRES,E.R.SILVEIRA,O.D.L.PESSOA |
| Literature Reference Citation | QUIM.NOVA,36,1111(2013) |
| Literature Reference DOI | 10.1590/s0100-40422013000800006 |
| Molecular Weight | 582.602 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWIR12029 |