| Phytochemical Name : Corynoxeine |
| PCNDIDC0255 |
| Pubchem CID : 44568160 |
| Molecular formula: C22H26N2O4 |
| Canonical SMILES : COC=C(C1CC2C3(CCN2CC1C=C)C4=CC=CC=C4NC3=O)C(=O)OC |
Synonymes : Corynoxeine|630-94-4|UNII-27KIC0Q2VA|27KIC0Q2VA|CORYNOXEIN|Corynoxan-16-carboxylic acid, 16,17,18,19-tetradehydro-17-methoxy-2-oxo-, methyl ester, (7beta,16E,20alpha)-|methyl (E)-2-[(3R,6'R,7'S,8'aS)-6'-ethenyl-2-oxospiro[1H-indole-3,1'-3,5,6,7,8,8a-hexahydro-2H-indolizine]-7'-yl]-3-methoxyprop-2-enoate|delta18-RHYNCOPHYLLINE|delta18-RHYNCHOPHYLLINE|CHEMBL481358|SCHEMBL23259426|.DELTA.18-RHYNCOPHYLLINE|.DELTA.18-RHYNCHOPHYLLINE|DTXSID001318311|HY-N0590|MFCD20527288|s9306|CCG-268431|CS-3803|AC-34615|AS-76851|A14659|Q27254211|methyl (7beta,16E,20alpha)-17-methoxy-2-oxocorynoxa-16,18-dien-16-carboxylate|CORYNOXAN-16-CARBOXYLIC ACID, 16,17,18,19-TETRADEHYDRO-17-METHOXY-2-OXO-, METHYL ESTER, (7.BETA.,16E,20.ALPHA.)-|SPIRO(3H-INDOLE-3,1'(5'H)-INDOLIZINE)-7'-ACETIC ACID, 6'-ETHENYL-1,2,2',3',6',7',8',8'A-OCTAHYDRO-.ALPHA.-(METHOXYMETHYLENE)-2-OXO-, METHYL ESTER, (.ALPHA.E,1'R,6'R,7'S,8'AS)-|SPIRO(3H-INDOLE-3,1'(5'H)-INDOLIZINE)-7'-ACETIC ACID, 6'-ETHENYL-1,2,2',3',6',7',8',8'A-OCTAHYDRO-alpha-(METHOXYMETHYLENE)-2-OXO-, METHYL ESTER, (alphaE,1'R,6'R,7'S,8'AS)- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.510 |
| Log Po/w (XLOGP3) : 2.060 |
| Log Po/w (WLOGP) : 1.520 |
| Log Po/w (MLOGP) : 1.940 |
| Log Po/w (SILICOS-IT) : 2.540 |
| Consensus Log Po/w : 2.310 |