Murexine
AlkaPlorer ID: AK307075
Synonym: 2-[[3-(1H-Imidazol-4-yl)-1-oxo-2-propenyl]oxy]-N,N,N-trimethylethanaminium(1+), Choline imidazole-4-acrylate, Choline urocanate
IUPAC Name: None
Structure
SMILES: C[N+](C)(C)CCOC(=O)/C=C\C1=CNC=N1
InChI: InChI=1S/C11H17N3O2/c1-14(2,3)6-7-16-11(15)5-4-10-8-12-9-13-10/h4-5,8-9H,6-7H2,1-3H3/p+1
InChIKey: XDPGNNXEHPAHCJ-UHFFFAOYSA-O
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Murex | Muricidae | Neogastropoda | Gastropoda | Mollusca | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 224.284
TPSA？: 54.98
MolLogP？: 0.6722999999999997
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|