(1R,2S)-2-[(S)-amino(carboxy)methyl]cyclopropane-1-carboxylic acid
AlkaPlorer ID: AK008570
Synonym: None
IUPAC Name: (1R,2S)-2-[(S)-amino(carboxy)methyl]cyclopropane-1-carboxylic acid
Structure
SMILES: N[C@H](C(=O)O)[C@H]1C[C@H]1C(=O)O
InChI: InChI=1S/C6H9NO4/c7-4(6(10)11)2-1-3(2)5(8)9/h2-4H,1,7H2,(H,8,9)(H,10,11)/t2-,3+,4-/m0/s1
InChIKey: GZOVEPYOCJWRFC-NUNKFHFFSA-N
Reference
Four cyclopropane amino acids from Ephedra
PubChem CID: 5310957
CAS: 117857-95-1
LOTUS: LTS0123660
SuperNatural Ⅲ: SN0119570-02
NPASS: NPC222327
Source
Properties Information
Molecule Weight: 159.141
TPSA?: 100.62000000000002
MolLogP?: -0.881
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 | Excitatory amino acid transporter 2 | IC50 | 4000.0 | nM | 10.1021/jm100959g |
| Rattus norvegicus | Glutamate NMDA receptor | IC50 | 10000.0 | nM | 10.1021/jm00086a004 |
| None | No relevant target | pKa | 2.1 | None | 10.1021/jm9502908 |
| None | No relevant target | pKa | 4.3 | None | 10.1021/jm9502908 |
| None | No relevant target | pKa | 10.0 | None | 10.1021/jm9502908 |
| None | Unchecked | Potency | 19952.6 | nM | None |
