Elliptinol
AlkaPlorer ID: AK297368
Synonym: None
IUPAC Name: (E)-N-[4-hydroxy-1-[[(E)-3-phenylprop-2-enoyl]amino]butyl]-2-methylbut-2-enamide
Structure
SMILES: C/C=C(\C)C(O)=NC(CCCO)N=C(O)/C=C/C1=CC=CC=C1
InChI: InChI=1S/C18H24N2O3/c1-3-14(2)18(23)20-16(10-7-13-21)19-17(22)12-11-15-8-5-4-6-9-15/h3-6,8-9,11-12,16,21H,7,10,13H2,1-2H3,(H,19,22)(H,20,23)/b12-11+,14-3+
InChIKey: JMDVMZLAYKHRCD-WKWZSVOQSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aglaia elliptifolia | Aglaia | Meliaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 316.401
TPSA？: 85.41000000000001
MolLogP？: 3.677600000000002
Number of H-Donors: 3
Number of H-Acceptors: 3
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | A549 | ED50 | 50.0 | ug ml-1 | 10.1021/np000341q |
| Homo sapiens | HL-60 | ED50 | 32.1 | ug ml-1 | 10.1021/np000341q |
| Homo sapiens | HT-29 | ED50 | 50.0 | ug ml-1 | 10.1021/np000341q |
| Homo sapiens | KB | ED50 | 50.0 | ug ml-1 | 10.1021/np000341q |
| Mus musculus | P388 | ED50 | 3.62 | ug ml-1 | 10.1021/np000341q |