Compound details
Euphornin G
| Compound ID | CDAMM01833 |
|---|---|
| Common name | Euphornin G | IUPAC name | (4,11-diacetyloxy-3a-hydroxy-2,5,8,8,12-pentamethyl-9-oxo-1,2,3,4,5,10,11,13a-octahydrocyclopenta[12]annulen-1-yl) benzoate |
| Molecular formula | C31H40O8 |
Experimental data
| Retention time | 3.18 |
|---|---|
| Adduct | [M+H]+ |
| Actual mz | 541.277 | Theoretical mz | 541.279 |
| Error | 4.94 |
| Ionizaton mode | Positive |
| Instrument type | LC-MS/MS-QTOF, spectrum predicted by MS-DIAL v4.9 integrated with MS-FINDER 3.60 |
| Score | 6.9238 |
Identifiers and class information
| Inchi key | DQMPCOCRFCCCNZ-ISSFDRLWNA-N |
|---|---|
| Smiles | O=C(OC1C2C=C(C)C(OC(=O)C)CC(=O)C(C=CC(C)C(OC(=O)C)C2(O)CC1C)(C)C)C=3C=CC=CC3 |
| Superclass | Lipids and lipid-like molecules |
| Class | Prenol lipids |
Plant source
External sources
| HMDB ID | |
|---|---|
| KNApSAcK ID | C00039181 |
| FooDB ID | |
| DrugBank ID | |
| ChEBI ID | |
| Pubchem Compound ID | 163076065 |
| PlantCyc ID | |
| UNPD ID | UNPD184056 |
| Coconut ID | CNP0376594 |
| LipidMAPS ID | |
| NANPDB ID | NANPDB_2270 |