| Phytochemical Name : Angeloylgomisin H |
| PCNDIDA0140 |
| Pubchem CID : 26204131 |
| Molecular formula: C28H36O8 |
| Canonical SMILES : CC=C(C)C(=O)OC1=C2C(=CC(=C1OC)OC)CC(C(CC3=CC(=C(C(=C32)OC)OC)OC)(C)O)C |
Synonymes : Angeloylgomisin H|UNII-Y16R9MI4T6|66056-22-2|Y16R9MI4T6|2-Butenoic acid, 2-methyl-, (6S,7S,12aR)-5,6,7,8-tetrahydro-7-hydroxy-2,3,10,11,12-pentamethoxy-6,7-dimethyldibenzo(a,C)cycloocten-1-yl ester, (2Z)-|[(9S,10S)-10-hydroxy-4,5,14,15,16-pentamethoxy-9,10-dimethyl-3-tricyclo[10.4.0.02,7]hexadeca-1(16),2,4,6,12,14-hexaenyl] (Z)-2-methylbut-2-enoate|CHEMBL1092320|SCHEMBL10040207|CHEBI:184022|AKOS040760113|AC-34147|Q27294127 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 4.400 |
| Log Po/w (XLOGP3) : 5.010 |
| Log Po/w (WLOGP) : 4.750 |
| Log Po/w (MLOGP) : 2.450 |
| Log Po/w (SILICOS-IT) : 5.550 |
| Consensus Log Po/w : 4.430 |