| SpectraBase Compound ID | 6NBedXFN556 |
|---|---|
| InChI | InChI=1S/C20H28O4/c1-6-19(4)10-13(16(21)22)20(5)12-8-7-9-18(2,3)15(12)17(23)24-14(20)11-19/h6,13-14H,1,7-11H2,2-5H3,(H,21,22)/t13-,14-,19+,20-/m0/s1 |
| InChIKey | NTAKAWMWMVZWTA-LHHVKLHASA-N |
| Mol Weight | 332.44 g/mol |
| Molecular Formula | C20H28O4 |
| Exact Mass | 332.198759 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | En2tudMtmno |
|---|---|
| Name | CANDIDALACTONE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H28O4 |
| InChI | InChI=1S/C20H28O4/c1-6-19(4)10-13(16(21)22)20(5)12-8-7-9-18(2,3)15(12)17(23)24-14(20)11-19/h6,13-14H,1,7-11H2,2-5H3,(H,21,22)/t13-,14-,19+,20-/m0/s1 |
| InChIKey | NTAKAWMWMVZWTA-LHHVKLHASA-N |
| Literature Reference Author | L.M.M.VALENTE,A.A.L.GUNATILAKA,G.G.I.KINGSTON,M.L.PATITUCCI, A.C.PINTO |
| Literature Reference Citation | J.NAT.PROD.,60,478(1997) |
| Literature Reference DOI | 10.1021/np960695a |
| Molecular Weight | 332.440 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP653 |