| SpectraBase Compound ID | L5wY4hH5iPc |
|---|---|
| InChI | InChI=1S/C25H34O10/c1-11-8-18-16(12(2)23(30)33-18)9-17-15(11)6-7-25(17,5)35-24-21(29)22(32-14(4)27)20(28)19(34-24)10-31-13(3)26/h15-22,24,28-29H,1-2,6-10H2,3-5H3/t15-,16+,17+,18+,19+,20+,21+,22-,24-,25+/m0/s1 |
| InChIKey | SWLAMBRETNNVQF-KHTBCIMESA-N |
| Mol Weight | 494.5 g/mol |
| Molecular Formula | C25H34O10 |
| Exact Mass | 494.215197 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FOMX3iPDgq3 |
|---|---|
| Name | 3-ACETYL-LEMMONIN_A |
| Compound Number | 15 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H34O10 |
| InChI | InChI=1S/C25H34O10/c1-11-8-18-16(12(2)23(30)33-18)9-17-15(11)6-7-25(17,5)35-24-21(29)22(32-14(4)27)20(28)19(34-24)10-31-13(3)26/h15-22,24,28-29H,1-2,6-10H2,3-5H3/t15-,16+,17+,18+,19+,20+,21+,22-,24-,25+/m0/s1 |
| InChIKey | SWLAMBRETNNVQF-KHTBCIMESA-N |
| Literature Reference Author | A.A.AHMED,O.SPRING,M.H.A.EL-RAZEK,N.S.HUSSEIN,T.J.MABRY |
| Literature Reference Citation | PHYTOCHEM.,39,1127(1995) |
| Literature Reference DOI | 10.1016/0031-9422(95)00014-X |
| Molecular Weight | 494.539 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ7702 |