7-(4-Aminophenyl)-2,4-dimethyl-7-oxo-5-heptenoic acid
AlkaPlorer ID: AK287144
Synonym: None
IUPAC Name: (E)-7-(4-aminophenyl)-2,4-dimethyl-7-oxohept-5-enoic acid
Structure
SMILES: CC(/C=C/C(=O)C1=CC=C(N)C=C1)CC(C)C(=O)O
InChI: InChI=1S/C15H19NO3/c1-10(9-11(2)15(18)19)3-8-14(17)12-4-6-13(16)7-5-12/h3-8,10-11H,9,16H2,1-2H3,(H,18,19)/b8-3+
InChIKey: JNYXIBXBHMJEBQ-FPYGCLRLSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Kandelia candel | Kandelia | Rhizophoraceae | Malpighiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Streptomyces griseus | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 261.321
TPSA？: 80.39
MolLogP？: 2.754600000000001
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | HeLa | Activity | None | None | 10.1021/np0500777 |
| Homo sapiens | K562 | Activity | None | None | 10.1021/np0500777 |
| Mus musculus | L929 | Activity | None | None | 10.1021/np0500777 |
| None | Unchecked | Activity | None | None | 10.1021/np0500777 |