| SpectraBase Compound ID | 84sk7pZ958K |
|---|---|
| InChI | InChI=1S/C27H42O2/c1-18(2)7-6-8-20(4)24-13-14-25-23(26(29)15-16-27(24,25)5)12-10-21-17-22(28)11-9-19(21)3/h9,11,17-18,20,23-25,28H,6-8,10,12-16H2,1-5H3/t20?,23-,24+,25-,27+/m0/s1 |
| InChIKey | OZROZYIBIZOAQQ-ACKXLEBFSA-N |
| Mol Weight | 398.6 g/mol |
| Molecular Formula | C27H42O2 |
| Exact Mass | 398.318481 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3XlIPuAnQDW |
|---|---|
| Name | CALICOFEROL-E |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H42O2 |
| InChI | InChI=1S/C27H42O2/c1-18(2)7-6-8-20(4)24-13-14-25-23(26(29)15-16-27(24,25)5)12-10-21-17-22(28)11-9-19(21)3/h9,11,17-18,20,23-25,28H,6-8,10,12-16H2,1-5H3/t20?,23-,24+,25-,27+/m0/s1 |
| InChIKey | OZROZYIBIZOAQQ-ACKXLEBFSA-N |
| Literature Reference Author | Y.SEO,J.SHIN,J.I.SONG |
| Literature Reference Citation | J.NAT.PROD.,58,1291(1995) |
| Literature Reference DOI | 10.1021/np50122a024 |
| Molecular Weight | 398.629 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWPR1742 |