| SpectraBase Compound ID | CwwsBk05b41 |
|---|---|
| InChI | InChI=1S/C25H34O9/c1-6-10(2)20(29)34-17-16-12(4)18(27)25(31)22-23(5)13(11(3)7-14(26)19(23)28)8-15(33-21(17)30)24(16,22)9-32-25/h7,10,12-13,15-19,22,27-28,31H,6,8-9H2,1-5H3/t10?,12-,13+,15-,16-,17-,18-,19-,22?,23-,24+,25+/m1/s1 |
| InChIKey | GCIFFNDSOLTCAI-UMDLFDGJSA-N |
| Mol Weight | 478.5 g/mol |
| Molecular Formula | C25H34O9 |
| Exact Mass | 478.220283 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LXQgrKpxwUz |
|---|---|
| Name | AILANTHINONE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H34O9 |
| InChI | InChI=1S/C25H34O9/c1-6-10(2)20(29)34-17-16-12(4)18(27)25(31)22-23(5)13(11(3)7-14(26)19(23)28)8-15(33-21(17)30)24(16,22)9-32-25/h7,10,12-13,15-19,22,27-28,31H,6,8-9H2,1-5H3/t10?,12-,13+,15-,16-,17-,18-,19-,22?,23-,24+,25+/m1/s1 |
| InChIKey | GCIFFNDSOLTCAI-UMDLFDGJSA-N |
| Literature Reference Author | Y.USAMI,K.NAKAGAWA-GOTO,J.Y.LANG,Y.KIM,C.Y.LAI,M.GOTO,N.SAKU RAI,M.TANIGUCHI,T.AK |
| Literature Reference Citation | J.NAT.PROD.,73,1553(2010) |
| Literature Reference DOI | 10.1021/np100406d |
| Molecular Weight | 478.540 g/mol |
| Sample ID | 36361 |
| Solvent | CDCl3 |