| Phytochemical Name : 2H-Cyclopropa[a]naphthalen-2-one, 1,1a,4,5,6,7,7a,7b-octahydro-1,1,7,7a-tetramethyl-, (1aalpha,7alpha,7aalpha,7balpha)- |
| PCNDIDOT0591 |
| Pubchem CID : 6432651 |
| Molecular formula: C15H22O |
| Canonical SMILES : CC1CCCC2=CC(=O)C3C(C12C)C3(C)C |
Synonymes : 2H-Cyclopropa[a]naphthalen-2-one, 1,1a,4,5,6,7,7a,7b-octahydro-1,1,7,7a-tetramethyl-, (1a.alpha.,7.alpha.,7a.alpha.,7b.alpha.)-|2H-Cyclopropa[a]naphthalen-2-one, 1,1a.beta.,4,5,6,7,7a,7b.beta.-octahydro-1,1,7.beta.,7a.beta.-tetramethyl-|Aristol-9-en-8-one # |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 2.800 |
| Log Po/w (XLOGP3) : 3.590 |
| Log Po/w (WLOGP) : 3.590 |
| Log Po/w (MLOGP) : 3.560 |
| Log Po/w (SILICOS-IT) : 3.580 |
| Consensus Log Po/w : 3.420 |