| Phytochemical Name : (+/-)-6-Acetonyldihydrosanguinarine |
| PCNDIDOT0063 |
| Pubchem CID : 181538 |
| Molecular formula: C23H19NO5 |
| Canonical SMILES : CC(=O)CC1C2=C(C=CC3=C2OCO3)C4=C(N1C)C5=CC6=C(C=C5C=C4)OCO6 |
Synonymes : 6-Acetonyldihydrosanguinarine|37687-34-6|8-Acetonyldihydrosanguinarine|(+/-)-6-Acetonyldihydrosanguinarine|6-Acetonyl-5,6-dihydrosanguinarine|xi-8-Acetonyldihydrosanguinarine|1-(24-methyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-1(13),2,4(8),9,11,14(22),15,17(21)-octaen-23-yl)propan-2-one|(S)-(+)-6-Acetonyldihydrosanguinarine; 6-Acetonyl-5,6-dihydrosanguinarine|CHEBI:31022|DTXSID201307625|HY-N2696|(+/-)-8-Acetonyldihydrosanguinarine|NSC129231|AKOS032948740|NSC 129231|NSC-129231|CS-0023146|Q27114072|[1,6-c]-1,3-dioxolo[4,5-i]phenanthridine, 13,14-dihydro-13-methyl-14-(2-oxopropyl)-|1-(24-methyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.0^{2,10.0^{4,8.0^{14,22.0^{17,21]tetracosa-1(13),2,4(8),9,11,14(22),15,17(21)-octaen-23-yl)propan-2-one|1-{24-methyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.0^{2,10}.0^{4,8}.0^{14,22}.0^{17,21}]tetracosa-1,3,8,10,12,14(22),15,17(21)-octaen-23-yl}propan-2-one|2-Propanone,14-dihydro-13-methyl[1,3]benzo- dioxolo[5,6-c]-1,3-dioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridin-14-yl)- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.350 |
| Log Po/w (XLOGP3) : 3.810 |
| Log Po/w (WLOGP) : 3.730 |
| Log Po/w (MLOGP) : 2.630 |
| Log Po/w (SILICOS-IT) : 4.260 |
| Consensus Log Po/w : 3.560 |