None
AlkaPlorer ID: AK323569
Synonym: None
IUPAC Name: (2S,3S)-2-amino-3-(3,4-dimethoxyphenyl)-3-hydroxypropanoic acid
Structure
SMILES: COC1=CC=C([C@H](O)[C@H](N)C(=O)O)C=C1OC
InChI: InChI=1S/C11H15NO5/c1-16-7-4-3-6(5-8(7)17-2)10(13)9(12)11(14)15/h3-5,9-10,13H,12H2,1-2H3,(H,14,15)/t9-,10-/m0/s1
InChIKey: ZKPVWZDNDNCTBB-UWVGGRQHSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Leucophyllum ambiguum | Leucophyllum | Scrophulariaceae | Lamiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 241.243
TPSA？: 102.01000000000002
MolLogP？: 0.1490999999999997
Number of H-Donors: 3
Number of H-Acceptors: 5
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Acetylcholinesterase | IC50 | 1.0 | nM | 10.1021/acs.jnatprod.9b00759 |
| Homo sapiens | Acetylcholinesterase | Inhibition | 70.0 | % | 10.1021/acs.jnatprod.9b00759 |