L-selenomethionine

Details

• Internal ID: 43d63c21-7f2e-4884-8b57-c3480a372f49
• Taxonomy: Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Alpha amino acids and derivatives > Alpha amino acids > L-alpha-amino acids
• IUPAC Name: (2S)-2-amino-4-methylselanylbutanoic acid
• SMILES (Canonical): C[Se]CCC(C(=O)O)N
• SMILES (Isomeric): C[Se]CC[C@@H](C(=O)O)N
• InChI: InChI=1S/C5H11NO2Se/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/t4-/m0/s1
• InChI Key: RJFAYQIBOAGBLC-BYPYZUCNSA-N
• Popularity: 2,086 references in papers

Physical and Chemical Properties

• Molecular Formula: C₅H₁₁NO₂Se
• Molecular Weight: 196.12 g/mol
• Exact Mass: 196.99550 g/mol
• Topological Polar Surface Area (TPSA): 63.30 Ų
• XlogP: 0.00

Synonyms

• 3211-76-5
• Seleno-L-methionine
• Selenium-L-methionine
• (S)-2-Amino-4-(methylselanyl)butanoic acid
• L-Selenomethioninum
• L-(+)-Selenomethionine
• SeMet
• (S)-2-Amino-4-(methylseleno)butyric acid
• (S)-2-Amino-4-(methylseleno)butanoic acid
• (2S)-2-amino-4-(methylseleno)butanoic acid
• Butyric acid, 2-amino-4-(methylselenyl)-, L-
• Butanoic acid, 2-amino-4-(methylseleno)-, (S)-
• SelenoSource AF 2000
• MFCD00037210
• (2S)-2-amino-4-methylselanylbutanoic acid
• UNII-964MRK2PEL
• NSC-760370
• Butanoic acid, 2-amino-4-(methylseleno)-, (2S)-
• selenomax
• vitaselenium
• 964MRK2PEL
• C5H11NO2Se
• DTXSID8046824
• CHEBI:30021
• NCGC00181044-01
• MSE
• C5-H11-N-O2-Se
• (2S)-2-amino-4-methylselanyl-butanoic acid
• Megavite RX
• Seleno-DL-methionine;DL-Selenomethionine
• Methionine, seleno-
• DIPROPYLSULFATE
• L(+)-Selenomethionine
• Bio sel-5000
• bmse000169
• SELENOMETHIONINE, L-
• (s)-(+)-2-amino-4-(methylseleno)butanoic acid
• SCHEMBL63322
• SELENOMETHIONINE [MI]
• L-Selenomethionine trit 0.5%
• SELENOMETHIONINE [HSDB]
• CHEMBL113178
• DTXCID6026824
• L-SELENOMETHIONINE [FCC]
• SELENOMETHIONINE [MART.]
• HY-B1000A
• BioSel 5000 L-Selenomethionine
• SELENOMETHIONINE [USP-RS]
• SELENOMETHIONINE [WHO-DD]
• RJFAYQIBOAGBLC-BYPYZUCNSA-N
• 2-amino-4-(methylseleno)butanoate
• HMS3264C04
• Pharmakon1600-01506163
• 2-Amino-4-(methylselenyl)butyrate
• AMY18854
• Tox21_112692
• NSC760370
• s3973
• AKOS015853989
• AKOS015889703
• AC-5676
• CCG-207973
• CS-5178
• DB11142
• NSC 760370
• (S)-2-Amino-4-(methylseleno)butanoate
• NCGC00181044-04
• (2S)-2-amino-4-(methylseleno)butanoate
• (S)-2-amino-4-(methylseleno)-Butanoate
• LS-46093
• CAS-3211-76-5
• L-2-amino-4-(methylselenyl)-Butyric acid
• alpha-amino-gamma-(methylseleno)butyric acid
• S0442
• (S)-2-amino-4-(methylseleno)-Butanoic acid
• Seleno-L-methionine, >=98% (TLC), powder
• C05335
• F20529
• AB01563198_01
• A821136
• J-018640
• Q27096144
• .ALPHA.-AMINO-.GAMMA.-(METHYLSELENO)BUTYRIC ACID
• 2905D820-1EFF-4468-93D0-BD1605569F30
• Selenomethionine, United States Pharmacopeia (USP) Reference Standard

2D Structure

ADMET Properties (via admetSAR 2)

Target	Value	Probability (raw)	Probability (%)
No predicted properties yet!

Targets

Proven Targets:

CHEMBL ID	UniProt ID	Name	Min activity	Assay type	Source
CHEMBL1293235	P02545	Prelamin-A/C	631 nM	Potency	via Super-PRED

Predicted Targets (via Super-PRED):

CHEMBL ID	UniProt ID	Name	Probability	Model accuracy
CHEMBL3251	P19838	Nuclear factor NF-kappa-B p105 subunit	96.60%	96.09%
CHEMBL2581	P07339	Cathepsin D	88.91%	98.95%
CHEMBL236	P41143	Delta opioid receptor	88.63%	99.35%
CHEMBL3976	Q9UHL4	Dipeptidyl peptidase II	86.69%	92.29%
CHEMBL3060	Q9Y345	Glycine transporter 2	83.76%	99.17%
CHEMBL1907591	P30926	Neuronal acetylcholine receptor; alpha4/beta4	83.07%	100.00%
CHEMBL221	P23219	Cyclooxygenase-1	82.23%	90.17%
CHEMBL4793	Q86TI2	Dipeptidyl peptidase IX	81.42%	96.95%

Plants that contains it

• Allium sativum
• Aniba megaphylla
• Berberis integerrima
• Brassica oleracea
• Calocedrus decurrens
• Digitalis sceptrum
• Herbertus sakuraii
• Nauclea latifolia
• Orthopappus angustifolius
• Scurrula parasitica

Cross-Links

• PubChem: 105024
• NPASS: NPC291186
• ChEMBL: CHEMBL113178
• LOTUS: LTS0227125
• wikiData: Q27096144