ID | 1687 |
Name | Carbethoxy reticuline |
Pubchem ID | 619498 |
KEGG ID | N/A |
Source | N/A |
Type | Unknown |
Function | Unknown |
Drug Like Properties | Yes |
Molecular Weight | 401.45 |
Exact mass | 401.183838 |
Molecular formula | C22H27NO6 |
XlogP | 3.6 |
Topological Polar Surface Area | 88.5 |
H-Bond Donor | 2 |
H-Bond Acceptor | 6 |
Rotational Bond Count | 6 |
IUPAC Name | ethyl7-hydroxy-1-[(5-hydroxy-4-methoxy-2-methylphenyl)methyl]-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate |
Structure | |
SDF file | |
MOL file | |
PDB file | |
Canonical SMILE | CCOC(=O)N1CCC2=CC(=C(C=C2C1CC3=CC(=C(C=C3C)OC)O)O)OC |
Isomeric SMILE | N/A |
Drugpedia | wiki |
References | 1. Source 2. Function 3. All Records |