| SpectraBase Compound ID | 3lsRrIRv8Ar |
|---|---|
| InChI | InChI=1S/C30H44O9/c1-15-23(32)25(35-4)24(33)26(37-15)38-18-5-8-27(2)17(12-18)13-21-30(39-21)20(27)7-9-28(3)19(6-10-29(28,30)34)16-11-22(31)36-14-16/h11,15,17-21,23-26,32-34H,5-10,12-14H2,1-4H3/t15-,17-,18-,19-,20+,21+,23-,24-,25+,26-,27-,28+,29+,30-/m0/s1 |
| InChIKey | LVGNJQMAMYJAIL-DXLGIPOKSA-N |
| Mol Weight | 548.7 g/mol |
| Molecular Formula | C30H44O9 |
| Exact Mass | 548.298533 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4fC8wroAWCr |
|---|---|
| Name | 17-ALPHA-NERIIFOLIN |
| Compound Number | II |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H44O9 |
| InChI | InChI=1S/C30H44O9/c1-15-23(32)25(35-4)24(33)26(37-15)38-18-5-8-27(2)17(12-18)13-21-30(39-21)20(27)7-9-28(3)19(6-10-29(28,30)34)16-11-22(31)36-14-16/h11,15,17-21,23-26,32-34H,5-10,12-14H2,1-4H3/t15-,17-,18-,19-,20+,21+,23-,24-,25+,26-,27-,28+,29+,30-/m0/s1 |
| InChIKey | LVGNJQMAMYJAIL-DXLGIPOKSA-N |
| Literature Reference Author | T.YAMAUCHI,F.ABE,A.S.C.WAN |
| Literature Reference Citation | CHEM.PHARM.BULL.,35,2744(1987) |
| Literature Reference DOI | 10.1248/cpb.35.2744 |
| Molecular Weight | 548.674 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWBK228 |