1.0 2020-05-05 15:49:49 UTC 2020-05-06 23:01:50 UTC BMDB0109682 (2E)-Decenoyl-ACP 1-Amino-1-carboxycyclopentane 1-Amino-1-cyclopentanecarboxylic acid 1-Aminocyclopentane-1-carboxylic acid ACPC Cyclo-leucine Cycloleucin Cycloleucine 1-Aminocyclopentanecarboxylic acid 1-Amino-1-cyclopentanecarboxylate 1-Aminocyclopentane-1-carboxylate 1-Aminocyclopentanecarboxylate 1026, NSC Aminocyclopentanecarboxylic acid Acid, aminocyclopentanecarboxylic 1 Aminocyclopentanecarboxylic acid Acid, 1-aminocyclopentanecarboxylic C6H11NO2 129.157 129.078978601 1-aminocyclopentane-1-carboxylic acid cycloleucine 52-52-8 NC1(CCCC1)C(O)=O InChI=1S/C6H11NO2/c7-6(5(8)9)3-1-2-4-6/h1-4,7H2,(H,8,9) NILQLFBWTXNUOE-UHFFFAOYSA-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 acids D-alpha-amino acids Hydrocarbon derivatives Monoalkylamines Monocarboxylic acids and derivatives Organic oxides Organopnictogen compounds Aliphatic homomonocyclic compound Amine Amino acid Carbonyl group Carboxylic acid D-alpha-amino acid Hydrocarbon derivative L-alpha-amino acid Monocarboxylic acid or derivatives Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Primary aliphatic amine Primary amine Aliphatic homomonocyclic compounds non-proteinogenic alpha-amino acid logp -2.30 ALOGPS logs 0.12 ALOGPS logp -1.8 ChemAxon pka_strongest_acidic 2.48 ChemAxon pka_strongest_basic 9.83 ChemAxon iupac 1-aminocyclopentane-1-carboxylic acid ChemAxon average_mass 129.157 ChemAxon mono_mass 129.078978601 ChemAxon smiles NC1(CCCC1)C(O)=O ChemAxon formula C6H11NO2 ChemAxon inchi InChI=1S/C6H11NO2/c7-6(5(8)9)3-1-2-4-6/h1-4,7H2,(H,8,9) ChemAxon inchikey NILQLFBWTXNUOE-UHFFFAOYSA-N ChemAxon polar_surface_area 63.32 ChemAxon refractivity 32.46 ChemAxon polarizability 13.23 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 3 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon number_of_rings 1 ChemAxon bioavailability 1 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::CMs 959 Specdb::CMs 1067 Specdb::CMs 7807 Specdb::CMs 30809 Specdb::CMs 31998 Specdb::CMs 31999 Specdb::CMs 48805 Specdb::CMs 135901 Specdb::CMs 143635 Specdb::MsMs 256050 Specdb::MsMs 256051 Specdb::MsMs 256052 Specdb::MsMs 275991 Specdb::MsMs 275992 Specdb::MsMs 275993 Specdb::MsMs 437158 Specdb::MsMs 437159 Specdb::MsMs 437160 Specdb::MsMs 437161 Specdb::MsMs 437162 Specdb::MsMs 445586 Specdb::MsMs 445587 Specdb::MsMs 445588 Specdb::MsMs 445589 Specdb::MsMs 445590 Specdb::MsMs 447901 Specdb::MsMs 447902 Specdb::MsMs 2246843 Specdb::MsMs 2391553 Specdb::MsMs 2391554 Specdb::MsMs 2391555 Specdb::MsMs 2570645 Specdb::MsMs 2570646 Specdb::MsMs 2570647 Specdb::MsIr 10419 Specdb::MsIr 10420 Specdb::MsIr 10421 Specdb::NmrOneD 65972 Specdb::NmrOneD 65973 Specdb::NmrOneD 65974 Specdb::NmrOneD 65975 Specdb::NmrOneD 65976 Specdb::NmrOneD 65977 Specdb::NmrOneD 65978 Specdb::NmrOneD 65979 Specdb::NmrOneD 65980 Specdb::NmrOneD 65981 Specdb::NmrOneD 65982 Specdb::NmrOneD 65983 Specdb::NmrOneD 65984 Specdb::NmrOneD 65985 Specdb::NmrOneD 65986 Specdb::NmrOneD 65987 Specdb::NmrOneD 65988 Specdb::NmrOneD 65989 Specdb::NmrOneD 65990 Specdb::NmrOneD 65991 Liver 8 multiparous Chinese Holstein dairy cows fed in the Hangzhou Hangjiang Dairy Farm based on the milk production under alfalfa hay based diets. Detection used gas chromatography time-of-flight/mass spectrometry (GC-TOF/MS) platform. Sun HZ, Zhou M, Wang O, Chen Y, Liu JX, Guan LL: Multi-omics reveals functional genomic and metabolic mechanisms of milk production and quality in dairy cows. Bioinformatics. 2020 Apr 15;36(8):2530-2537. doi: 10.1093/bioinformatics/btz951. 31873721 Liver 8 multiparous Chinese Holstein dairy cows fed in the Hangzhou Hangjiang Dairy Farm based on the milk production under alfalfa hay based diets. Detection used gas chromatography time-of-flight/mass spectrometry (GC-TOF/MS) platform. Sun HZ, Zhou M, Wang O, Chen Y, Liu JX, Guan LL: Multi-omics reveals functional genomic and metabolic mechanisms of milk production and quality in dairy cows. Bioinformatics. 2020 Apr 15;36(8):2530-2537. doi: 10.1093/bioinformatics/btz951. 31873721 Mammary Gland 8 multiparous Chinese Holstein dairy cows fed in the Hangzhou Hangjiang Dairy Farm based on the milk production under alfalfa hay based diets. Detection used gas chromatography time-of-flight/mass spectrometry (GC-TOF/MS) platform. Sun HZ, Zhou M, Wang O, Chen Y, Liu JX, Guan LL: Multi-omics reveals functional genomic and metabolic mechanisms of milk production and quality in dairy cows. Bioinformatics. 2020 Apr 15;36(8):2530-2537. doi: 10.1093/bioinformatics/btz951. 31873721 DB04620 2901 C03969 40547 Cycloleucine