| Phytochemical Name : Imperialine |
| PCNDIDI0012 |
| Pubchem CID : 442977 |
| Molecular formula: C27H43NO3 |
| Canonical SMILES : CC1CCC2C(C3CCC4C(C3CN2C1)CC5C4CC(=O)C6C5(CCC(C6)O)C)(C)O |
Synonymes : Imperialine|sipeimine|61825-98-7|Kashmirine|Cevan-6-one, 3,20-dihydroxy-, (3-beta,5-alpha,17-beta)-|UNII-JKN43410XZ|JKN43410XZ|(3-beta,5-alpha,17-beta)-3,20-Dihydroxycevan-6-one|C27H43NO3|Cevan-6-one, 3,20-dihydroxy-, (3.beta.,5.alpha.,17.beta.)-|(1R,2S,6S,9S,10S,11R,14S,15S,18S,20S,23R,24S)-10,20-dihydroxy-6,10,23-trimethyl-4-azahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacosan-17-one|Imperialin|C27-H43-N-O3|NSC-282170|Imperialine ,(S)|Imperialine (6CI,7CI)|CHEMBL1623724|CHEBI:184104|DTXSID001031589|HY-N0696|BDBM50270727|MFCD00171661|s9233|AKOS001580849|CCG-269000|CS-3729|NSC 282170|LS-52877|MS-27627|peiminine, (3beta,5alpha,17beta)-isomer|3beta,20beta-dihydroxy-6-one-5alpha-cevanine|SR-01000805467|Q-100713|SR-01000805467-3|Q17107392|(3S,4aS,6aS,6bS,8aR,9S,9aS,12S,15aS,15bR,16aS,16bR)-3,9-dihydroxy-9,12,16b-trimethyldocosahydrobenzo[4,5]indeno[1,2-h]pyrido[1,2-b]isoquinolin-5(1H)-one |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.820 |
| Log Po/w (XLOGP3) : 3.850 |
| Log Po/w (WLOGP) : 3.510 |
| Log Po/w (MLOGP) : 3.680 |
| Log Po/w (SILICOS-IT) : 2.750 |
| Consensus Log Po/w : 3.520 |