Phyto4Health

Se-methylselenocysteine

Representations & DB's id

ChEBI: CHEBI:27812
ChEMBL: CHEMBL62382
PubChem: 147004
IUPAC: (2R)-2-amino-3-methylselanylpropanoic acid
Standard InChI: InChI=1S/C4H9NO2Se/c1-8-2-3(5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m0/s1
Standard InChI Key: XDSSPSLGNGIIHP-VKHMYHEASA-N
SMILES: C[Se]C[C@@H](C(=O)O)N

Molecular propeties

AlogP: -1.0329
Hydrogen bonds acceptors: 3
Hydrogen bonds donors: 2
Rotatable bonds: 3
Number of rings: 0
Molecular Weight: 182.98
Topological polar surface area: 63.3
Number of aromatic rings: 0
Fsp3: 0.75
Number of carbons: 4

Plant sources

Part of plant Plant name Ref.
PlantPanax ginseng
PlantPanax ginseng
PlantPanax ginseng

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.
Potency16360.1 nMNuclear factor erythroid 2-related factor 2Q16236
Potency631 nMHistone-lysine N-methyltransferase, H3 lysine-9 specific 3Q96KQ7
Potency29081 nMATPase family AAA domain-containing protein 5Q96QE3