| Phytochemical Name : Glycyrol |
| PCNDIDG0118 |
| Pubchem CID : 5320083 |
| Molecular formula: C21H18O6 |
| Canonical SMILES : CC(=CCC1=C(C2=C(C=C1O)OC(=O)C3=C2OC4=C3C=CC(=C4)O)OC)C |
Synonymes : Glycyrol|Neoglycyrol|23013-84-5|6C3DSA537F|CHEBI:80832|3,9-dihydroxy-1-methoxy-2-(3-methylbut-2-enyl)-[1]benzofuro[3,2-c]chromen-6-one|1,9-Dihydroxy-3-methoxy-2-prenylcoumestan|6H-Benzofuro[3,2-c][1]benzopyran-6-one, 3,9-dihydroxy-1-methoxy-2-(3-methyl-2-buten-1-yl)-|3,9-DIHYDROXY-1-METHOXY-2-(3-METHYL-2-BUTEN-1-YL)-6H-BENZOFURO(3,2-C)(1)BENZOPYRAN-6-ONE|6H-BENZOFURO(3,2-C)(1)BENZOPYRAN-6-ONE, 3,9-DIHYDROXY-1-METHOXY-2-(3-METHYL-2-BUTEN-1-YL)-|3,9-dihydroxy-1-methoxy-2-(3-methylbut-2-en-1-yl)-6H-(1)benzofuro(3,2-c)(1)benzopyran-6-one|3,9-dihydroxy-1-methoxy-2-(3-methylbut-2-en-1-yl)-6H-[1]benzofuro[3,2-c][1]benzopyran-6-one|3,9-Dihydroxy-1-methoxy-2-prenylcoumestan|UNII-6C3DSA537F|MLS000697623|SCHEMBL758197|CHEMBL132695|DTXSID00177569|HMS2270J05|HY-N3961|YAA01384|AKOS032949068|MS-25857|SMR000470955|CS-0024524|FT-0775552|C16968|Q27149874|3,9-Dihydroxy-1-methoxy-2-(3-methyl-but-2-enyl)-benzofuro[3,2-c][1]benzopyran-6-one|3,9-dihydroxy-1-methoxy-2-(3-methylbut-2-enyl)benzofuro[3,2-c]chromen-6-one|6H-Benzofuro(3,2-c)(1)benzopyran-6-one, 3,9-dihydroxy-1-methoxy-2-(3-methyl-2-butenyl)- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.190 |
| Log Po/w (XLOGP3) : 4.660 |
| Log Po/w (WLOGP) : 4.620 |
| Log Po/w (MLOGP) : 2.550 |
| Log Po/w (SILICOS-IT) : 4.620 |
| Consensus Log Po/w : 3.930 |