| SpectraBase Compound ID | 2EnsU7aR2oS |
|---|---|
| InChI | InChI=1S/C31H52O12/c1-18-7-11-30(19(2)5-4-6-22(30)29(18,3)10-8-20(13-33)9-12-32)16-41-27-25(37)24(36)23(35)21(43-27)14-40-28-26(38)31(39,15-34)17-42-28/h5,9,18,21-28,32-39H,4,6-8,10-17H2,1-3H3/b20-9-/t18-,21-,22-,23-,24+,25-,26+,27-,28-,29+,30-,31-/m1/s1 |
| InChIKey | NPAOTDZSUNRTOM-HPNCYPAFSA-N |
| Mol Weight | 616.7 g/mol |
| Molecular Formula | C31H52O12 |
| Exact Mass | 616.345877 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6CrCzVgeqas |
|---|---|
| Name | CUSSOSIDE-D |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H52O12 |
| InChI | InChI=1S/C31H52O12/c1-18-7-11-30(19(2)5-4-6-22(30)29(18,3)10-8-20(13-33)9-12-32)16-41-27-25(37)24(36)23(35)21(43-27)14-40-28-26(38)31(39,15-34)17-42-28/h5,9,18,21-28,32-39H,4,6-8,10-17H2,1-3H3/b20-9-/t18-,21-,22-,23-,24+,25-,26+,27-,28-,29+,30-,31-/m1/s1 |
| InChIKey | NPAOTDZSUNRTOM-HPNCYPAFSA-N |
| Literature Reference Author | R.R.H.LIVA,R.KASAI,K.YAMASAKI |
| Literature Reference Citation | PHYTOCHEM.,60,339(2002) |
| Literature Reference DOI | 10.1016/S0031-9422(02)00064-X |
| Molecular Weight | 616.747 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS1639 |