| Phytochemical Name : 14-Deoxy-11,12-didehydroandrographolide |
| PCNDIDOT0399 |
| Pubchem CID : 5708351 |
| Molecular formula: C20H28O4 |
| Canonical SMILES : CC12CCC(C(C1CCC(=C)C2C=CC3=CCOC3=O)(C)CO)O |
Synonymes : 42895-58-9|14-Deoxy-11,12-didehydroandrographolide|14-Deoxy-11,12-dehydroandrographolide|AP-10|UNII-5S0X4YZJ0E|5S0X4YZJ0E|11,12-Didehydro-14-deoxyandrographolide|4-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one|CHEBI:69808|2(5H)-Furanone, 3-((1E)-2-((1R,4aS,5R,6R,8aR)-decahydro-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-1-naphthalenyl)ethenyl)-|3-{(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidenedecahydronaphthalen-1-yl]ethenyl}furan-2(5H)-one|14-dehydro Andrographolide;AP10|MLS001215174|CHEMBL361568|MEGxp0_000982|SCHEMBL20668923|DTXSID301347789|HMS2881G03|HY-N1490|BBL010995|MFCD07778081|STK802121|AKOS005622504|CS-7534|NCGC00163645-01|NCGC00163645-02|AC-34799|SMR000543109|14-Deoxy-11,12-didehydro andrographolide|E80829|SR-01000814886|A1-06836|SR-01000814886-4|Q27138150|14-Deoxy-11,12-didehydroandrographolide, analytical standard|14-DEOXY-11,12-DEHYDROANDROGRAPHOLIDE (CONSTITUENT OF ANDROGRAPHIS) [DSC] |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.850 |
| Log Po/w (XLOGP3) : 3.230 |
| Log Po/w (WLOGP) : 2.770 |
| Log Po/w (MLOGP) : 2.720 |
| Log Po/w (SILICOS-IT) : 3.540 |
| Consensus Log Po/w : 3.020 |