1.0 2018-07-17 17:50:31 UTC 2020-03-13 17:36:55 UTC BMDB0062570 BMDB62570 O-Succinyl-L-homoserine O-Succinyl-L-homoserine belongs to the class of organic compounds known as l-alpha-amino acids. These are alpha amino acids which have the L-configuration of the alpha-carbon atom. O-Succinyl-L-homoserine is possibly soluble (in water) and a very strong basic compound (based on its pKa). O-Succinylhomoserine O4-Succinyl-L-homoserine O-Succinylhomoserine, (DL)-isomer C8H13NO6 219.1919 219.074287153 (2S)-2-amino-4-[(3-carboxypropanoyl)oxy]butanoic acid O-succinyl-L-homoserine 1492-23-5 N[C@@H](CCOC(=O)CCC(O)=O)C(O)=O InChI=1S/C8H13NO6/c9-5(8(13)14)3-4-15-7(12)2-1-6(10)11/h5H,1-4,9H2,(H,10,11)(H,13,14)/t5-/m0/s1 GNISQJGXJIDKDJ-YFKPBYRVSA-N belongs to the class of organic compounds known as l-alpha-amino acids. These are alpha amino acids which have the L-configuration of the alpha-carbon atom. Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues L-alpha-amino acids Amino acids Carbonyl compounds Carboxylic acid esters Carboxylic acids Fatty acid esters Hydrocarbon derivatives Monoalkylamines Organic oxides Organopnictogen compounds Tricarboxylic acids and derivatives Aliphatic acyclic compound Amine Amino acid Carbonyl group Carboxylic acid Carboxylic acid ester Fatty acid ester Fatty acyl Hydrocarbon derivative L-alpha-amino acid Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Primary aliphatic amine Primary amine Tricarboxylic acid or derivatives Aliphatic acyclic compounds o-succinylhomoserine logp -3.31 ALOGPS logs -1.40 ALOGPS logp -3.6 ChemAxon pka_strongest_acidic 1.69 ChemAxon pka_strongest_basic 9.46 ChemAxon iupac (2S)-2-amino-4-[(3-carboxypropanoyl)oxy]butanoic acid ChemAxon average_mass 219.1919 ChemAxon mono_mass 219.074287153 ChemAxon smiles N[C@@H](CCOC(=O)CCC(O)=O)C(O)=O ChemAxon formula C8H13NO6 ChemAxon inchi InChI=1S/C8H13NO6/c9-5(8(13)14)3-4-15-7(12)2-1-6(10)11/h5H,1-4,9H2,(H,10,11)(H,13,14)/t5-/m0/s1 ChemAxon inchikey GNISQJGXJIDKDJ-YFKPBYRVSA-N ChemAxon polar_surface_area 126.92 ChemAxon refractivity 46.95 ChemAxon polarizability 20.51 ChemAxon rotatable_bond_count 8 ChemAxon acceptor_count 6 ChemAxon donor_count 3 ChemAxon physiological_charge -1 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 3191 Specdb::MsMs 25253 Specdb::MsMs 25254 Specdb::MsMs 25255 Specdb::MsMs 31811 Specdb::MsMs 31812 Specdb::MsMs 31813 Specdb::NmrOneD 4997 Specdb::NmrOneD 4998 Specdb::NmrOneD 327452 Specdb::NmrOneD 327453 Specdb::NmrOneD 327454 Specdb::NmrOneD 327455 Specdb::NmrOneD 327456 Specdb::NmrOneD 327457 Specdb::NmrOneD 327458 Specdb::NmrOneD 327459 Specdb::NmrOneD 327460 Specdb::NmrOneD 327461 Specdb::NmrOneD 327462 Specdb::NmrOneD 327463 Specdb::NmrOneD 327464 Specdb::NmrOneD 327465 Specdb::NmrOneD 327466 Specdb::NmrOneD 327467 Specdb::NmrOneD 327468 Specdb::NmrOneD 327469 Specdb::NmrOneD 327470 Specdb::NmrOneD 327471 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 C01118 FDB031067 388523 16160 439406 O-SUCCINYL-L-HOMOSERINE C00019621 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