| SpectraBase Compound ID | Kxs3gDPpj0T |
|---|---|
| InChI | InChI=1S/C26H40O4/c1-9-18(3)24(28)30-22-16-20(5)25(6,14-13-17(2)15-23(27)29-8)21-12-10-11-19(4)26(21,22)7/h9,11,15,20-22H,10,12-14,16H2,1-8H3/b17-15+,18-9-/t20-,21-,22-,25+,26+/m1/s1 |
| InChIKey | GRAKDQZADDSMPS-UDINGOFWSA-N |
| Mol Weight | 416.6 g/mol |
| Molecular Formula | C26H40O4 |
| Exact Mass | 416.29266 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GW4XtNly6Jh |
|---|---|
| Name | METHYL-6-ANGELOYLOXYClERODA-3,13-DIEN-15-OATE |
| Compound Number | 16 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H40O4 |
| InChI | InChI=1S/C26H40O4/c1-9-18(3)24(28)30-22-16-20(5)25(6,14-13-17(2)15-23(27)29-8)21-12-10-11-19(4)26(21,22)7/h9,11,15,20-22H,10,12-14,16H2,1-8H3/b17-15+,18-9-/t20-,21-,22-,25+,26+/m1/s1 |
| InChIKey | GRAKDQZADDSMPS-UDINGOFWSA-N |
| Literature Reference Author | M.TORI,A.KATTO,M.SONO |
| Literature Reference Citation | PHYTOCHEM.,52,487(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(99)00273-3 |
| Molecular Weight | 416.601 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN627 |