| BioID | bio198131 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL2048119 |
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| Molecular Formula | C15H22O4 |
|---|
| Molecular Weight | 266.34 |
|---|
| Molecular Weight (Monoisotopic) | 266.1518 |
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| Type | Small molecule |
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| Max Phase | -- |
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| Target ID | Tar81 |
|---|
| Target Name | None |
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| Synonyms | 2-Methoxyethyl 4,5-Didehydrojasmonate |
|---|
| Smiles | CC/C=C\C[C@H]1C(=O)C=C[C@H]1CC(=O)OCCOC |
|---|
| Inchi | InChI=1S/C15H22O4/c1-3-4-5-6-13-12(7-8-14(13)16)11-15(17)19-10-9-18-2/h4-5,7-8,12-13H,3,6,9-11H2,1-2H3/b5-4-/t12-,13+/m0/s1 |
|---|
| Inchi Key | HCMLRXBIRLCSKK-OEFFGFFESA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 2.0 |
|---|
| Bioactivities | 5.0 |
|---|
| Np Likeness Score | 1.37 |
|---|
| Records Key | ['14'] |
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| Records Name | ['2-Methoxyethyl 4,5-didehydrojasmonate'] |
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| Withdrawn Flag | False |
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| Orphan | -1 |
|---|
