| SpectraBase Compound ID | 4X7VnfN9fDC |
|---|---|
| InChI | InChI=1S/C20H26O4/c1-12-13-4-5-17-19(2,7-3-8-20(17,11-21)18(22)23)15(13)10-16-14(12)6-9-24-16/h6,9,13,15,17,21H,1,3-5,7-8,10-11H2,2H3,(H,22,23)/t13-,15-,17+,19+,20+/m0/s1 |
| InChIKey | QIHOKLBFXIBNNW-YFALUVIFSA-N |
| Mol Weight | 330.42 g/mol |
| Molecular Formula | C20H26O4 |
| Exact Mass | 330.183109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DYtkcvkqR61 |
|---|---|
| Name | CORDYLANE_D;CASSA-12,14-(17),15-TRIEN-19-ALPHA-HYDROXY-18-BETA-OIC_ACID |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H26O4 |
| InChI | InChI=1S/C20H26O4/c1-12-13-4-5-17-19(2,7-3-8-20(17,11-21)18(22)23)15(13)10-16-14(12)6-9-24-16/h6,9,13,15,17,21H,1,3-5,7-8,10-11H2,2H3,(H,22,23)/t13-,15-,17+,19+,20+/m0/s1 |
| InChIKey | QIHOKLBFXIBNNW-YFALUVIFSA-N |
| Literature Reference Author | Y.HOU,S.CAO,P.BRODIE,J.S.MILLER,C.BIRKINSHAW,F.RATOVOSON,R.R AKOTONDRAJAONA,R.AND |
| Literature Reference Citation | J.NAT.PROD.,71,150(2008) |
| Literature Reference DOI | 10.1021/np070437l |
| Molecular Weight | 330.424 g/mol |
| Sample ID | 27078 |
| Solvent | CD3OD |