ID | 2744 |
Name | Narcein |
Pubchem ID | 8564 |
KEGG ID | C09591 |
Source | Papaver rhopalothece |
Type | Natural |
Function | Antitussive |
Drug Like Properties | Yes |
Molecular Weight | 445.46 |
Exact mass | 445.173667 |
Molecular formula | C23H27NO8 |
XlogP | 0.5 |
Topological Polar Surface Area | 104 |
H-Bond Donor | 1 |
H-Bond Acceptor | 9 |
Rotational Bond Count | 10 |
IUPAC Name | 6-[2-[6-(2-dimethylaminoethyl)-4-methoxy-1,3-benzodioxol-5-yl]acetyl]-2,3-dimethoxybenzoic acid |
Structure | |
SDF file | |
MOL file | |
PDB file | |
Canonical SMILE | CN(C)CCC1=CC2=C(C(=C1CC(=O)C3=C(C(=C(C=C3)OC)OC)C(=O)O)OC)OCO2 |
Isomeric SMILE | N/A |
Drugpedia | wiki |
References | 1. Sariyar,Planta Med.,56,(1990),232 2. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21 3. Source 4. Function 5. All Records |