ID | 2556 |
Name | Lophophorine |
Pubchem ID | 442315 |
KEGG ID | C09573 |
Source | Lophophora williamsii |
Type | Natural |
Function | Convulsions |
Drug Like Properties | Yes |
Molecular Weight | 235.28 |
Exact mass | 235.120843 |
Molecular formula | C13H17NO3 |
XlogP | 2 |
Topological Polar Surface Area | 30.9 |
H-Bond Donor | 0 |
H-Bond Acceptor | 4 |
Rotational Bond Count | 1 |
IUPAC Name | (9S)-4-methoxy-8,9-dimethyl-7,9-dihydro-6H-[1,3]dioxolo[4,5-h]isoquinoline |
Structure | |
SDF file | |
MOL file | |
PDB file | |
Canonical SMILE | CC1C2=C3C(=C(C=C2CCN1C)OC)OCO3 |
Isomeric SMILE | C[C@H]1C2=C3C(=C(C=C2CCN1C)OC)OCO3 |
Drugpedia | wiki |
References | 1. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21 2. Source 3. Function 4. All Records |