| SpectraBase Compound ID | 5elSFiexfQh |
|---|---|
| InChI | InChI=1S/C20H32O2/c1-14(13-18(21)22)7-9-16-15(2)8-10-17-19(3,4)11-6-12-20(16,17)5/h7,16-17H,2,6,8-13H2,1,3-5H3,(H,21,22)/b14-7-/t16-,17-,20+/m0/s1 |
| InChIKey | JSNVJPLVHIOLEM-YPCBCADOSA-N |
| Mol Weight | 304.5 g/mol |
| Molecular Formula | C20H32O2 |
| Exact Mass | 304.24023 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5FstVfL9feV |
|---|---|
| Name | CALCARATARIN-B;(Z)-LABDA-8(17),12-DIEN-15-OIC-ACID |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H32O2 |
| InChI | InChI=1S/C20H32O2/c1-14(13-18(21)22)7-9-16-15(2)8-10-17-19(3,4)11-6-12-20(16,17)5/h7,16-17H,2,6,8-13H2,1,3-5H3,(H,21,22)/b14-7-/t16-,17-,20+/m0/s1 |
| InChIKey | JSNVJPLVHIOLEM-YPCBCADOSA-N |
| Literature Reference Author | L.Y.KONG,M.J.QIN,M.NIWA |
| Literature Reference Citation | J.NAT.PROD.,63,939(2000) |
| Literature Reference DOI | 10.1021/np9904962 |
| Molecular Weight | 304.473 g/mol |
| Solvent | CDCl3 |