| SpectraBase Compound ID | ACNLfvO6d2E |
|---|---|
| InChI | InChI=1S/C32H42O15/c1-16(2)10-25(38)47-30-26-21(11-23(36)32(26,41)15-44-17(3)34)19(13-42-30)14-43-31-29(28(40)27(39)22(12-33)45-31)46-24(37)9-6-18-4-7-20(35)8-5-18/h4-9,13,16,21-23,26-31,33,35-36,39-41H,10-12,14-15H2,1-3H3/b9-6+/t21?,22-,23-,26?,27-,28+,29-,30-,31-,32+/m0/s1 |
| InChIKey | AAALJWLFINEDCQ-NPBQYPDUSA-N |
| Mol Weight | 666.7 g/mol |
| Molecular Formula | C32H42O15 |
| Exact Mass | 666.252371 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9phCAqXMiv9 |
|---|---|
| Name | VIBRUTINOSIDE-II |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H42O15 |
| InChI | InChI=1S/C32H42O15/c1-16(2)10-25(38)47-30-26-21(11-23(36)32(26,41)15-44-17(3)34)19(13-42-30)14-43-31-29(28(40)27(39)22(12-33)45-31)46-24(37)9-6-18-4-7-20(35)8-5-18/h4-9,13,16,21-23,26-31,33,35-36,39-41H,10-12,14-15H2,1-3H3/b9-6+/t21?,22-,23-,26?,27-,28+,29-,30-,31-,32+/m0/s1 |
| InChIKey | AAALJWLFINEDCQ-NPBQYPDUSA-N |
| Literature Reference Author | L.TOMASSINI,M.F.COMETA,S.FODDAI,M.NICOLETTI |
| Literature Reference Citation | PHYTOCHEM.,38,423(1995) |
| Literature Reference DOI | 10.1016/0031-9422(94)00618-4 |
| Molecular Weight | 666.676 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMS4741 |