Phyto4Health

D-Aspartate

Representations & DB's id

ChEBI: CHEBI:17364
ChEMBL: CHEMBL29757
PubChem: 83887
IUPAC: (2R)-2-aminobutanedioic acid
Standard InChI: InChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/t2-/m1/s1
Standard InChI Key: CKLJMWTZIZZHCS-UWTATZPHSA-N
SMILES: OC(=O)C[C@H](C(=O)O)N

Molecular propeties

AlogP: -1.13
Hydrogen bonds acceptors: 3
Hydrogen bonds donors: 3
Rotatable bonds: 3
Number of rings: 0
Molecular Weight: 133.04
Topological polar surface area: 101
Number of aromatic rings: 0
Fsp3: 0.5
Number of carbons: 4

Plant sources

Part of plant Plant name Ref.
PlantBrassica juncea
PlantTussilago farfara
PlantGlycyrrhiza glabra

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.
Potency7943.3 nMThyroid stimulating hormone receptorP16473
Potency7943.3 nMThyroid stimulating hormone receptorP16473