1.0 2011-09-21 01:58:25 UTC 2015-07-21 06:59:46 UTC FDB029611 8-[(Aminomethyl)sulfanyl]-6-sulfanyloctanoic acid 8-[(aminomethyl)sulfanyl]-6-sulfanyloctanoic acid is a intermediate of the glycine cleavage system. It can be found covalently attached to the H-protein of the glycine cleavage system. [HMDB] C9H19NO2S2 237.383 237.085720237 8-[(aminomethyl)sulfanyl]-6-sulfanyloctanoic acid 8-[(aminomethyl)sulfanyl]-6-sulfanyloctanoic acid NCSCCC(S)CCCCC(O)=O InChI=1S/C9H19NO2S2/c10-7-14-6-5-8(13)3-1-2-4-9(11)12/h8,13H,1-7,10H2,(H,11,12) YNZQCBXDUUGFIX-UHFFFAOYSA-N belongs to the class of organic compounds known as medium-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 4 and 12 carbon atoms. Medium-chain fatty acids Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty acids and conjugates Aliphatic acyclic compounds Alkylthiols Carbonyl compounds Carboxylic acids Dialkylthioethers Hydrocarbon derivatives Monoalkylamines Monocarboxylic acids and derivatives Organic oxides Organopnictogen compounds Sulfenyl compounds Thia fatty acids Thiohemiaminal derivatives Aliphatic acyclic compound Alkylthiol Carbonyl group Carboxylic acid Carboxylic acid derivative Dialkylthioether Hemithioaminal Hydrocarbon derivative Medium-chain fatty acid Monocarboxylic acid or derivatives Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Organosulfur compound Primary aliphatic amine Sulfenyl compound Thia fatty acid Thioether Solid logp -0.43 ALOGPS logs -3.31 ALOGPS solubility 1.16e-01 g/l ALOGPS logp -0.83 ChemAxon pka_strongest_acidic 4.35 ChemAxon pka_strongest_basic 8.32 ChemAxon iupac 8-[(aminomethyl)sulfanyl]-6-sulfanyloctanoic acid ChemAxon average_mass 237.383 ChemAxon mono_mass 237.085720237 ChemAxon smiles NCSCCC(S)CCCCC(O)=O ChemAxon formula C9H19NO2S2 ChemAxon inchi InChI=1S/C9H19NO2S2/c10-7-14-6-5-8(13)3-1-2-4-9(11)12/h8,13H,1-7,10H2,(H,11,12) ChemAxon inchikey YNZQCBXDUUGFIX-UHFFFAOYSA-N ChemAxon polar_surface_area 63.32 ChemAxon refractivity 63.68 ChemAxon polarizability 26.96 ChemAxon rotatable_bond_count 9 ChemAxon acceptor_count 3 ChemAxon donor_count 3 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Ammonia Recycling SMP00009 map00910 Glycine and Serine Metabolism SMP00004 map00260 Specdb::CMs 24458 Specdb::CMs 40145 Specdb::CMs 168426 Specdb::MsMs 320116 Specdb::MsMs 320117 Specdb::MsMs 320118 Specdb::MsMs 367435 Specdb::MsMs 367436 Specdb::MsMs 367437 Specdb::MsMs 2359781 Specdb::MsMs 2359782 Specdb::MsMs 2359783 Specdb::MsMs 2606239 Specdb::MsMs 2606240 Specdb::MsMs 2606241 Specdb::NmrOneD 99738 Specdb::NmrOneD 99739 Specdb::NmrOneD 99740 Specdb::NmrOneD 99741 Specdb::NmrOneD 99742 Specdb::NmrOneD 99743 Specdb::NmrOneD 99744 Specdb::NmrOneD 99745 Specdb::NmrOneD 99746 Specdb::NmrOneD 99747 Specdb::NmrOneD 99748 Specdb::NmrOneD 99749 Specdb::NmrOneD 99750 Specdb::NmrOneD 99751 Specdb::NmrOneD 99752 Specdb::NmrOneD 99753 Specdb::NmrOneD 99754 Specdb::NmrOneD 99755 Specdb::NmrOneD 99756 Specdb::NmrOneD 99757 HMDB13639