Octopamine; (R)-form, 4-Me ether
AlkaPlorer ID: AK308494
Synonym: α-(Aminomethyl)-4-methoxybenzenemethanol, 4-Methoxy-β-hydroxyphenethylamine, Alkaloid NP
IUPAC Name: 2-amino-1-(4-methoxyphenyl)ethanol
Structure
SMILES: COC1=CC=C(C(O)CN)C=C1
InChI: InChI=1S/C9H13NO2/c1-12-8-4-2-7(3-5-8)9(11)6-10/h2-5,9,11H,6,10H2,1H3
InChIKey: LQEPONWCAMNCOY-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Coryphantha cornifera | Coryphantha | Cactaceae | Caryophyllales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 167.20799999999997
TPSA？: 55.48
MolLogP？: 0.6873000000000002
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Acinetobacter baumannii | Acinetobacter baumannii | Inhibition | 5.17 | % | 10.6019/CHEMBL4513160 |
| Pseudomonas aeruginosa | Pseudomonas aeruginosa | Inhibition | -29.27 | % | 10.6019/CHEMBL4513160 |
| Pseudomonas aeruginosa | Pseudomonas aeruginosa | Inhibition | -2.45 | % | 10.6019/CHEMBL4513160 |
| None | Unchecked | Percent Effect | 5.53 | % | 10.6019/CHEMBL3988442 |
| None | Unchecked | Percent Effect | 15.67 | % | 10.6019/CHEMBL3988442 |
| None | Unchecked | Percent Effect | 44.51 | % | 10.6019/CHEMBL3988442 |