| SpectraBase Compound ID | 9WMh71KCQHF |
|---|---|
| InChI | InChI=1S/C25H36O6/c1-5-15(2)19(26)31-17-12-25(29)22(4)9-6-8-21(3,20(27)28)18(22)7-10-23(25)11-16(17)24(13-23)14-30-24/h5,16-18,29H,6-14H2,1-4H3,(H,27,28)/b15-5-/t16-,17+,18+,21-,22+,23-,24+,25+/m0/s1 |
| InChIKey | VSHVDZGVXXVKRY-IEOSLKNGSA-N |
| Mol Weight | 432.6 g/mol |
| Molecular Formula | C25H36O6 |
| Exact Mass | 432.251189 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IfmmpdCHmOS |
|---|---|
| Name | ENT-12-ALPHA-ANGELOXY-16-BETA,17-EPOXY-9-ALPHA-HYDROXYKAURAN-18-OIC-ACID |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H36O6 |
| InChI | InChI=1S/C25H36O6/c1-5-15(2)19(26)31-17-12-25(29)22(4)9-6-8-21(3,20(27)28)18(22)7-10-23(25)11-16(17)24(13-23)14-30-24/h5,16-18,29H,6-14H2,1-4H3,(H,27,28)/b15-5-/t16-,17+,18+,21-,22+,23-,24+,25+/m0/s1 |
| InChIKey | VSHVDZGVXXVKRY-IEOSLKNGSA-N |
| Literature Reference Author | A.B.GUTIERREZ,W.HERZ |
| Literature Reference Citation | PHYTOCHEM.,29,1937(1990) |
| Literature Reference DOI | 10.1016/0031-9422(90)85043-F |
| Molecular Weight | 432.557 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU32204 |