| SpectraBase Compound ID | 2WQvWLOI5kC |
|---|---|
| InChI | InChI=1S/C22H30O6/c1-13-6-7-17-21(5,27-17)10-8-15-18(13)19(24)28-22(15,12-25-14(2)23)11-9-16-20(3,4)26-16/h9,11,15-18H,1,6-8,10,12H2,2-5H3/b11-9+/t15-,16?,17-,18-,21-,22-/m0/s1 |
| InChIKey | PTNNKASIHILQBL-FZLRUVKMSA-N |
| Mol Weight | 390.48 g/mol |
| Molecular Formula | C22H30O6 |
| Exact Mass | 390.204239 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FOz7tlTyUBF |
|---|---|
| Name | 3-ACETYL-14,15-EPOXY-XENIOLIDE_H |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H30O6 |
| InChI | InChI=1S/C22H30O6/c1-13-6-7-17-21(5,27-17)10-8-15-18(13)19(24)28-22(15,12-25-14(2)23)11-9-16-20(3,4)26-16/h9,11,15-18H,1,6-8,10,12H2,2-5H3/b11-9+/t15-,16?,17-,18-,21-,22-/m0/s1 |
| InChIKey | PTNNKASIHILQBL-FZLRUVKMSA-N |
| Literature Reference Author | A.A.H.ELGAMAL,S.K.WANG,C.Y.DUH |
| Literature Reference Citation | J.NAT.PROD.,69,338(2006) |
| Literature Reference DOI | 10.1021/np058093r |
| Molecular Weight | 390.477 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ18137 |