| Phytochemical Name : (1R)-1,6,6-trimethyl-1,2,6,7,8,9-hexahydrophenanthro[1,2-b]furan-10,11(3aH,11aH)-dione |
| PCNDIDOT0082 |
| Pubchem CID : 25181389 |
| Molecular formula: C19H22O3 |
| Canonical SMILES : CC1COC2C1C(=O)C(=O)C3=C2C=CC4=C3CCCC4(C)C |
Synonymes : (1R)-1,6,6-trimethyl-1,2,6,7,8,9-hexahydrophenanthro[1,2-b]furan-10,11(3aH,11aH)-dione|Cryptonshinone,(S)|CHEMBL4573182|(1R)-1,6,6-trimethyl-1,2,3a,6,7,8,9,11a-octahydrophenanthro[1,2-b]furan-10,11-dione |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 2.680 |
| Log Po/w (XLOGP3) : 3.500 |
| Log Po/w (WLOGP) : 3.070 |
| Log Po/w (MLOGP) : 2.440 |
| Log Po/w (SILICOS-IT) : 4.380 |
| Consensus Log Po/w : 3.210 |