| Phytochemical Name : Methyl 2-[(1S,2S)-3-oxo-2-[(2Z)-pent-2-EN-1-YL]cyclopentyl]acetate |
| PCNDIDM0076 |
| Pubchem CID : 6428089 |
| Molecular formula: C13H20O3 |
| Canonical SMILES : CCC=CCC1C(CCC1=O)CC(=O)OC |
Synonymes : 20073-13-6|METHYL 2-[(1S,2S)-3-OXO-2-[(2Z)-PENT-2-EN-1-YL]CYCLOPENTYL]ACETATE|(+)-(Z)-Methyl epijasmonate|(+)-cis-Methyl jasmonate|SCHEMBL36184|(+)-(Z)-methylepijasmonate|Methyl [1alpha,2beta(Z)]-(+-)-3-oxo-2-(pent-2-enyl)cyclopentaneacetate|DTXSID90859600|Cyclopentaneacetic acid, 3-oxo-2-(2Z)-2-pentenyl-, methyl ester, (1R,2R)-rel-|Cyclopentaneacetic acid, 3-oxo-2-(2-pentenyl)-, methyl ester, [1.alpha.,2.beta.(Z)]-(.+-.)-|Cyclopentaneacetic acid, 3-oxo-2-(2-pentenyl)-, methyl ester, [1.alpha.,2.beta.(Z)]-(.+.)-|rel-Methyl (1R,2R)-3-oxo-2-(2Z)-2-penten-1-ylcyclopentaneacetate |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 2.770 |
| Log Po/w (XLOGP3) : 1.920 |
| Log Po/w (WLOGP) : 2.500 |
| Log Po/w (MLOGP) : 1.950 |
| Log Po/w (SILICOS-IT) : 2.960 |
| Consensus Log Po/w : 2.420 |