| SpectraBase Compound ID | GDQlzz1nm4X |
|---|---|
| InChI | InChI=1S/C28H40O8/c1-23-12-17(18(13-23)36-22(32)26(23,4)33)27(34)10-8-15-14-11-21(31)28(35)20(30)6-5-19(29)25(28,3)16(14)7-9-24(15,27)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+/m0/s1 |
| InChIKey | YIUICDUSPHFGCI-HQMWPZTCSA-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 | 46Um8uBgnBP |
|---|---|
| Name | ANOMANOLIDE_B |
| Compound Number | 13 |
| 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)27(34)10-8-15-14-11-21(31)28(35)20(30)6-5-19(29)25(28,3)16(14)7-9-24(15,27)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+/m0/s1 |
| InChIKey | YIUICDUSPHFGCI-HQMWPZTCSA-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 | 30230 |
| Solvent | CDCl3 |