| Phytochemical Name : Deoxyneocryptotanshinone |
| PCNDIDD0078 |
| Pubchem CID : 15690458 |
| Molecular formula: C19H22O3 |
| Canonical SMILES : CC(C)C1=C(C2=C(C3=C(C=C2)C(CCC3)(C)C)C(=O)C1=O)O |
Synonymes : DEOXYNEOCRYPTOTANSHINONE|Neocryptotanshinone II|27468-20-8|1-hydroxy-8,8-dimethyl-2-propan-2-yl-6,7-dihydro-5H-phenanthrene-3,4-dione|1,4-Phenanthrenedione, 5,6,7,8-tetrahydro-3-hydroxy-2-isopropyl-8,8-dimethyl-|5,6,7,8-Tetrahydro-3-hydroxy-8,8-dimethyl-2-(1-methylethyl)-1,4-phenanthrenedione|NeocryptotanshinoneII|CHEMBL1813345|CBA46820|HY-N3734|AKOS032948958|AKOS040762101|CS-0024128 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.270 |
| Log Po/w (XLOGP3) : 3.470 |
| Log Po/w (WLOGP) : 3.890 |
| Log Po/w (MLOGP) : 1.820 |
| Log Po/w (SILICOS-IT) : 4.040 |
| Consensus Log Po/w : 3.300 |