Dopamine; N-(4-Hydroxy-E-cinnamoyl)
AlkaPlorer ID: AK297045
Synonym: N-trans-p-Coumaroyldopamine
IUPAC Name: (E)-N-[2-(3,4-dihydroxyphenyl)ethyl]-3-(4-hydroxyphenyl)prop-2-enamide
Structure
SMILES: OC(/C=C/C1=CC=C(O)C=C1)=NCCC1=CC=C(O)C(O)=C1
InChI: InChI=1S/C17H17NO4/c19-14-5-1-12(2-6-14)4-8-17(22)18-10-9-13-3-7-15(20)16(21)11-13/h1-8,11,19-21H,9-10H2,(H,18,22)/b8-4+
InChIKey: KZUJJPCTENPKOE-XBXARRHUSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Atraphaxis frutescens | Atraphaxis | Polygonaceae | Caryophyllales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Atraphaxis spinosa | Atraphaxis | Polygonaceae | Caryophyllales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 299.326
TPSA？: 93.28
MolLogP？: 3.0158000000000014
Number of H-Donors: 4
Number of H-Acceptors: 4
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Agaricus bisporus | Tyrosinase | Inhibition | nan | % | 10.1007/s00044-012-0419-x |
| None | No relevant target | IC50 | 72100.0 | nM | 10.1021/acs.jnatprod.6b00720 |
| None | Unchecked | IC50 | 1630.0 | nM | 10.1016/j.ejmech.2016.02.044 |
| None | Unchecked | IC50 | 92800.0 | nM | 10.1021/acs.jnatprod.6b00720 |
| None | Unchecked | IC50 | 4300000.0 | nM | 10.1021/acs.jnatprod.6b00720 |
| None | Unchecked | Ki | 1740.0 | nM | 10.1016/j.ejmech.2016.02.044 |