1.0 2018-07-17 17:23:30 UTC 2020-04-22 15:51:46 UTC BMDB0062258 BMDB62258 Serylmethionine Serylmethionine, also known as S-m dipeptide or ser-met, belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Serylmethionine is possibly soluble (in water) and a very strong basic compound (based on its pKa). L-Serinyl-L-methionine S-m Dipeptide Ser-met Serine methionine dipeptide Serine-methionine dipeptide Serinylmethionine SM Dipeptide L-Seryl-L-methionine Serylmethionine C8H16N2O4S 236.289 236.0830777 2-[(2-amino-1,3-dihydroxypropylidene)amino]-4-(methylsulfanyl)butanoic acid 2-[(2-amino-1,3-dihydroxypropylidene)amino]-4-(methylsulfanyl)butanoic acid CSCCC(N=C(O)C(N)CO)C(O)=O InChI=1S/C8H16N2O4S/c1-15-3-2-6(8(13)14)10-7(12)5(9)4-11/h5-6,11H,2-4,9H2,1H3,(H,10,12)(H,13,14) PBUXMVYWOSKHMF-UHFFFAOYSA-N belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Dipeptides Alpha amino acid amides Amino acids Carbonyl compounds Carboxylic acids Dialkylthioethers Hydrocarbon derivatives Hydroxy fatty acids Methionine and derivatives Monoalkylamines Monocarboxylic acids and derivatives N-acyl-alpha amino acids Organic oxides Organopnictogen compounds Primary alcohols Secondary carboxylic acid amides Serine and derivatives Sulfenyl compounds Thia fatty acids Alcohol Aliphatic acyclic compound Alpha-amino acid amide Alpha-amino acid or derivatives Alpha-dipeptide Amine Amino acid Amino acid or derivatives Carbonyl group Carboxamide group Carboxylic acid Dialkylthioether Fatty acid Fatty acyl Hydrocarbon derivative Hydroxy fatty acid Methionine or derivatives Monocarboxylic acid or derivatives N-acyl-alpha amino acid or derivatives N-acyl-alpha-amino acid Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Organosulfur compound Primary alcohol Primary aliphatic amine Primary amine Secondary carboxylic acid amide Serine or derivatives Sulfenyl compound Thia fatty acid Thioether Aliphatic acyclic compounds logp -2.49 ALOGPS logs -1.85 ALOGPS logp -3.2 ChemAxon pka_strongest_acidic 3.04 ChemAxon pka_strongest_basic 9.01 ChemAxon iupac 2-[(2-amino-1,3-dihydroxypropylidene)amino]-4-(methylsulfanyl)butanoic acid ChemAxon average_mass 236.289 ChemAxon mono_mass 236.0830777 ChemAxon smiles CSCCC(N=C(O)C(N)CO)C(O)=O ChemAxon formula C8H16N2O4S ChemAxon inchi InChI=1S/C8H16N2O4S/c1-15-3-2-6(8(13)14)10-7(12)5(9)4-11/h5-6,11H,2-4,9H2,1H3,(H,10,12)(H,13,14) ChemAxon inchikey PBUXMVYWOSKHMF-UHFFFAOYSA-N ChemAxon polar_surface_area 116.14 ChemAxon refractivity 56.95 ChemAxon polarizability 23.8 ChemAxon rotatable_bond_count 7 ChemAxon acceptor_count 6 ChemAxon donor_count 4 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon number_of_rings 0 ChemAxon bioavailability 1 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::CMs 19556 Specdb::CMs 41079 Specdb::MsMs 309508 Specdb::MsMs 309509 Specdb::MsMs 309510 Specdb::MsMs 353968 Specdb::MsMs 353969 Specdb::MsMs 353970 Milk By UPLC-Q-TOF Pan L, Yu J, Mi Z, Mo L, Jin H, Yao C, Ren D, Menghe B: A Metabolomics Approach Uncovers Differences between Traditional and Commercial Dairy Products in Buryatia (Russian Federation). Molecules. 2018 Mar 22;23(4). pii: molecules23040735. doi: 10.3390/molecules23040735. 29565828 14843114 Pan L, Yu J, Mi Z, Mo L, Jin H, Yao C, Ren D, Menghe B: A Metabolomics Approach Uncovers Differences between Traditional and Commercial Dairy Products in Buryatia (Russian Federation). Molecules. 2018 Mar 22;23(4). pii: molecules23040735. doi: 10.3390/molecules23040735. 29565828