| SpectraBase Compound ID | BNMlJmqlbiD |
|---|---|
| InChI | InChI=1S/C23H36O5/c1-14(10-21(26)27-7)8-9-22(5)16(3)19(28-17(4)24)13-23(6)15(2)11-18(25)12-20(22)23/h10-11,16,18-20,25H,8-9,12-13H2,1-7H3/b14-10+/t16-,18-,19-,20-,22+,23+/m1/s1 |
| InChIKey | JMMACFKOBKFRDJ-NQBARFFZSA-N |
| Mol Weight | 392.5 g/mol |
| Molecular Formula | C23H36O5 |
| Exact Mass | 392.256274 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | WGTeowJaJF |
|---|---|
| Name | METHYL-7-ACETOXY-2-BETA-HYDROXYClERODA-3,13-DIEN-15-OATE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H36O5 |
| InChI | InChI=1S/C23H36O5/c1-14(10-21(26)27-7)8-9-22(5)16(3)19(28-17(4)24)13-23(6)15(2)11-18(25)12-20(22)23/h10-11,16,18-20,25H,8-9,12-13H2,1-7H3/b14-10+/t16-,18-,19-,20-,22+,23+/m1/s1 |
| InChIKey | JMMACFKOBKFRDJ-NQBARFFZSA-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 | 392.536 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN617 |