| Phytochemical Name : Ruscogenin |
| PCNDIDR0049 |
| Pubchem CID : 441893 |
| Molecular formula: C27H42O4 |
| Canonical SMILES : CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(C(CC(C6)O)O)C)C)C)OC1 |
Synonymes : Ruscogenin|472-11-7|UNII-BXI92R2VUJ|BXI92R2VUJ|CHEBI:8913|Spirost-5-ene-1,3-diol, (1b,3b,25R)-|(1beta,3beta,25R)-Spirost-5-ene-1,3-diol|EINECS 207-447-2|(25R)-spirost-5-en-1beta,3beta-diol|(25R)-Spirost-5-ene-1beta,3beta-diol|Spirost-5-ene-1,3-diol, (1.beta.,3.beta.,25R)-|(25RS)-Ruscogenin|Ruscogenins|Ruscorectal (TN)|RUSCOGENIN [INCI]|RUSCOGENIN [MART.]|RUSCOGENIN [WHO-DD]|SCHEMBL147884|CHEMBL1169820|Ruscogenin, >=98% (HPLC)|DTXSID401019319|HY-N0496|LMST01080038|MFCD00210550|CCG-269015|AC-34398|CS-0009017|S9183|C08909|D08498|Q-201689|(25R)-SPIROST-5-ENE-1.BETA.,3.BETA.-DIOL|Q27108184|SPIROST-5-ENE-1.BETA.,3.BETA.-DIOL, (25R)-|Z2037319104|(1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R,14R,16R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-14,16-diol |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 4.270 |
| Log Po/w (XLOGP3) : 4.700 |
| Log Po/w (WLOGP) : 4.680 |
| Log Po/w (MLOGP) : 4.090 |
| Log Po/w (SILICOS-IT) : 3.390 |
| Consensus Log Po/w : 4.230 |