| SpectraBase Compound ID | 8fPlMxyyVSS |
|---|---|
| InChI | InChI=1S/C20H32O4/c1-13(9-10-21)5-7-16-14(2)6-8-17-19(16,3)11-15(22)12-20(17,4)18(23)24/h9,15-17,21-22H,2,5-8,10-12H2,1,3-4H3,(H,23,24)/b13-9+/t15-,16+,17?,19-,20+/m1/s1 |
| InChIKey | FWEBHQLHWQHDOT-MLVYBIJVSA-N |
| Mol Weight | 336.5 g/mol |
| Molecular Formula | C20H32O4 |
| Exact Mass | 336.23006 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DiICOHe595W |
|---|---|
| Name | 2-ALPHA-HYDROXYISOCUPRESSIC_ACID;2-ALPHA,15-DIHYDROXYLABDA-8-(17),13-(E)-DIEN-19-OIC_ACID |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H32O4 |
| InChI | InChI=1S/C20H32O4/c1-13(9-10-21)5-7-16-14(2)6-8-17-19(16,3)11-15(22)12-20(17,4)18(23)24/h9,15-17,21-22H,2,5-8,10-12H2,1,3-4H3,(H,23,24)/b13-9+/t15-,16+,17?,19-,20+/m1/s1 |
| InChIKey | FWEBHQLHWQHDOT-MLVYBIJVSA-N |
| Literature Reference Author | S.J.LIN,J.P.N.ROSAZZA |
| Literature Reference Citation | J.NAT.PROD.,61,922(1998) |
| Literature Reference DOI | 10.1021/np980064b |
| Molecular Weight | 336.472 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ1132 |