9-(4-Aminophenyl)-7-hydroxy-2,4,6-trimethyl-9-oxo-2-nonenoic acid
AlkaPlorer ID: AK287162
Synonym: None
IUPAC Name: (E)-9-(4-aminophenyl)-7-hydroxy-2,4,6-trimethyl-9-oxonon-2-enoic acid
Structure
SMILES: C/C(=C\C(C)CC(C)C(O)CC(=O)C1=CC=C(N)C=C1)C(=O)O
InChI: InChI=1S/C18H25NO4/c1-11(9-13(3)18(22)23)8-12(2)16(20)10-17(21)14-4-6-15(19)7-5-14/h4-7,9,11-12,16,20H,8,10,19H2,1-3H3,(H,22,23)/b13-9+
InChIKey: ZFJQEOCQSGFKLB-UKTHLTGXSA-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: 319.401
TPSA？: 100.62
MolLogP？: 2.8957000000000006
Number of H-Donors: 3
Number of H-Acceptors: 4
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 |