| Phytochemical Name : Friedelin |
| PCNDIDF0051 |
| Pubchem CID : 91472 |
| Molecular formula: C30H50O |
| Canonical SMILES : CC1C(=O)CCC2C1(CCC3C2(CCC4(C3(CCC5(C4CC(CC5)(C)C)C)C)C)C)C |
Synonymes : Friedelin|559-74-0|Friedeline|Friedelan-3-one|friedelanone|D:A-Friedooleanan-3-one|(-)-Friedelin|EINECS 209-205-1|UNII-AK21264UAD|AK21264UAD|CHEBI:5171|CHEMBL485998|NSC 55141|3-friedelanone|(4R,4aS,6aS,6bR,8aR,12aR,12bS,14aS,14bS)-4,4a,6b,8a,11,11,12b,14a-octamethylicosahydropicen-3(2H)-one|SR-05000002227|Fridelin|NSC-55141|3-OXOFRIEDELANE|FRIEDELIN [MI]|Friedelin, technical grade|(4R,4aS,6aS,6aS,6bR,8aR,12aR,14aS,14bS)-4,4a,6a,6b,8a,11,11,14a-octamethyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one|Friedelin, analytical standard|SCHEMBL193053|D:A-Friedooleanan-3-one (VAN)|DTXSID101015732|HY-N4110|BDBM50241943|MFCD00017296|AKOS015897124|CCG-208470|MS-27536|CS-0032118|C08626|SR-05000002227-2|SR-05000002227-3|Q15410972|24,25,26-Trinoroleanan-3-one, 5,9,13-trimethyl-,(4b,5b,8a,9b,10a,13a,14b)-|(4-beta,5-beta,8-alpha,9-beta,10-alpha,13-alpha,14-beta)-5,9,13-Trimethyl-24,25,26-trinoroleanan-3-one|24,25,26-TRINOROLEANAN-3-ONE, 5,9,13-TRIMETHYL-, (4.BETA.,5.BETA.,8.ALPHA.,9.BETA.,10.ALPHA.,13.ALPHA.,14.BETA.)-|3(2H)-Picenone, eicosahydro-4,4a,6b,8a,11,11,12b,14a-octamethyl-, (4R,4aS,6aS,6bR,8aR,12aR,12bS,14aS,14bS)-|3(2H)-PICENONE, EICOSAHYDRO-4,4A,6B,8A,11,11,12B,14A-OCTAMETHYL-, (4R-(4.ALPHA.,4A.ALPHA.,6A.BETA.,6B.ALPHA.,8A.ALPHA.,12A.ALPHA.,12B.BETA.,14A.ALPHA.,14B.BETA.))- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 4.520 |
| Log Po/w (XLOGP3) : 9.800 |
| Log Po/w (WLOGP) : 8.460 |
| Log Po/w (MLOGP) : 6.920 |
| Log Po/w (SILICOS-IT) : 7.520 |
| Consensus Log Po/w : 7.440 |