| SpectraBase Compound ID | IE922g83vUc |
|---|---|
| InChI | InChI=1S/C28H40O8/c1-23-12-17(18(13-23)36-22(32)26(23,4)33)28(35)21(31)11-16-14-10-20(30)27(34)8-5-6-19(29)25(27,3)15(14)7-9-24(16,28)2/h5-6,14-18,20-21,30-31,33-35H,7-13H2,1-4H3/t14-,15+,16+,17+,18-,20-,21-,23-,24+,25+,26+,27-,28-/m1/s1 |
| InChIKey | XBHRORXHTAXVQY-CTNWIMOFSA-N |
| Mol Weight | 504.6 g/mol |
| Molecular Formula | C28H40O8 |
| Exact Mass | 504.272318 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FiZuFz6Lb0I |
|---|---|
| Name | ANOMANOLIDE_E |
| Compound Number | 14 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H40O8 |
| InChI | InChI=1S/C28H40O8/c1-23-12-17(18(13-23)36-22(32)26(23,4)33)28(35)21(31)11-16-14-10-20(30)27(34)8-5-6-19(29)25(27,3)15(14)7-9-24(16,28)2/h5-6,14-18,20-21,30-31,33-35H,7-13H2,1-4H3/t14-,15+,16+,17+,18-,20-,21-,23-,24+,25+,26+,27-,28-/m1/s1 |
| InChIKey | XBHRORXHTAXVQY-CTNWIMOFSA-N |
| Literature Reference Author | P.W.HSIEH,Z.Y.HUANG,J.H.CHEN,F.R.CHANG,C.C.WU,Y.L.YANG,M.Y.C HIANG,M.H.YEN,S.L.CH |
| Literature Reference Citation | J.NAT.PROD.,70,747(2007) |
| Literature Reference DOI | 10.1021/np0605541 |
| Molecular Weight | 504.621 g/mol |
| Sample ID | 30231 |
| Solvent | C5D5N |