| SpectraBase Compound ID | 5gi9lqMhZ2p |
|---|---|
| InChI | InChI=1S/C25H32O3/c1-6-24(14-13-19-11-9-8-10-12-19)15-16(3)20-17(4)22(26)18(5)21(20)25(24,7-2)23(27)28/h8-15,17-18,20-21H,6-7H2,1-5H3,(H,27,28)/b14-13+/t17-,18-,20-,21-,24-,25-/m0/s1 |
| InChIKey | IUHRGTBLTYEFAP-FDGHYGKRSA-N |
| Mol Weight | 380.5 g/mol |
| Molecular Formula | C25H32O3 |
| Exact Mass | 380.235145 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CD6nMunESkP |
|---|---|
| Name | DINOR-SPICULOIC-ACID-A |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H32O3 |
| InChI | InChI=1S/C25H32O3/c1-6-24(14-13-19-11-9-8-10-12-19)15-16(3)20-17(4)22(26)18(5)21(20)25(24,7-2)23(27)28/h8-15,17-18,20-21H,6-7H2,1-5H3,(H,27,28)/b14-13+/t17-,18-,20-,21-,24-,25-/m0/s1 |
| InChIKey | IUHRGTBLTYEFAP-FDGHYGKRSA-N |
| Literature Reference Author | F.BERRUE,O.P.THOMAS,R.FERNANDEZ,P.AMADE |
| Literature Reference Citation | J.NAT.PROD.,68,547(2005) |
| Literature Reference DOI | 10.1021/np049602c |
| Molecular Weight | 380.527 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ9596 |