| SpectraBase Compound ID | 1IbBJ11q0mZ |
|---|---|
| InChI | InChI=1S/C27H40O5/c1-17(2)9-7-13-26(5)14-8-10-22-21(26)12-11-18(3)27(22,6)16-23(31-19(4)28)20-15-24(29)32-25(20)30/h10,15,18,21,23,25,30H,1,7-9,11-14,16H2,2-6H3/t18-,21+,23-,25?,26+,27+/m1/s1 |
| InChIKey | LUZPPGGVQBQOEH-GNAIDZQBSA-N |
| Mol Weight | 444.6 g/mol |
| Molecular Formula | C27H40O5 |
| Exact Mass | 444.287574 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9qz6RuUXyW5 |
|---|---|
| Name | CLADOCORAN-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H40O5 |
| InChI | InChI=1S/C27H40O5/c1-17(2)9-7-13-26(5)14-8-10-22-21(26)12-11-18(3)27(22,6)16-23(31-19(4)28)20-15-24(29)32-25(20)30/h10,15,18,21,23,25,30H,1,7-9,11-14,16H2,2-6H3/t18-,21+,23-,25?,26+,27+/m1/s1 |
| InChIKey | LUZPPGGVQBQOEH-GNAIDZQBSA-N |
| Literature Reference Author | A.FONTANA,M.L.CIAVATTA,G.CIMINO |
| Literature Reference Citation | J.ORG.CHEM.,63,2845(1998) |
| Literature Reference DOI | 10.1021/jo971586j |
| Molecular Weight | 444.612 g/mol |
| Sample ID | 37074 |
| Solvent | CDCl3 |