| SpectraBase Compound ID | F2cPFjtpEV7 |
|---|---|
| InChI | InChI=1S/C30H44O3/c1-18-8-10-23(33-26(18)32)19(2)20-12-16-30(7)22-9-11-24-27(3,4)25(31)14-15-28(24,5)21(22)13-17-29(20,30)6/h8,11,19-23H,9-10,12-17H2,1-7H3/t19-,20?,21?,22?,23-,28+,29+,30-/m0/s1 |
| InChIKey | DDPXDNJYIJKKCF-LJQITASASA-N |
| Mol Weight | 452.7 g/mol |
| Molecular Formula | C30H44O3 |
| Exact Mass | 452.329045 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GGbCX3HHUnf |
|---|---|
| Name | CENTAURIONE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H44O3 |
| InChI | InChI=1S/C30H44O3/c1-18-8-10-23(33-26(18)32)19(2)20-12-16-30(7)22-9-11-24-27(3,4)25(31)14-15-28(24,5)21(22)13-17-29(20,30)6/h8,11,19-23H,9-10,12-17H2,1-7H3/t19-,20?,21?,22?,23-,28+,29+,30-/m0/s1 |
| InChIKey | DDPXDNJYIJKKCF-LJQITASASA-N |
| Literature Reference Author | H.BIBI,S.ANWER,G.A.MIANA,S.AHMAD,A.U.RAHMAN |
| Literature Reference Citation | FITOTERAPIA,71,130(2000) |
| Literature Reference DOI | 10.1016/S0367-326X(99)00144-6 |
| Molecular Weight | 452.678 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN3803 |