1.0 2016-09-30 22:41:42 UTC 2020-05-19 22:01:34 UTC BMDB0001149 BMDB01149 5-Aminolevulinic acid 5-ALA 5-Amino-4-oxopentanoate 5-Amino-4-oxovaleric acid 5-Aminolevulinate Aminolevulinic acid DALA delta-ALA delta-Aminolevulinic acid 5-Amino-4-oxopentanoic acid 5-Amino-4-oxovalerate Aminolevulinate Δ-ala delta-Aminolevulinate Δ-aminolevulinate Δ-aminolevulinic acid 5-Amino-4-oxo-pentanoate 5-Amino-4-oxo-pentanoic acid 5-Amino-levulinate 5-Amino-levulinic acid 5-Aminolaevulinate 5-Aminolaevulinic acid Aladerm Amino-levulinic acid Kerastick 5 Aminolevulinate Acid, Delta-aminolevulinic Levulan 5 Aminolaevulinate Acid hydrochloride, aminolevulinic Bertek brand OF aminolevulinic acid hydrochloride Hydrochloride, aminolevulinic acid Acid, aminolevulinic Aminolevulinic acid hydrochloride Delta Aminolevulinic acid C5H9NO3 131.1299 131.058243159 5-amino-4-oxopentanoic acid aminolevulinic acid 106-60-5 NCC(=O)CCC(O)=O InChI=1S/C5H9NO3/c6-3-4(7)1-2-5(8)9/h1-3,6H2,(H,8,9) ZGXJTSGNIOSYLO-UHFFFAOYSA-N belongs to the class of organic compounds known as delta amino acids and derivatives. Delta amino acids and derivatives are compounds containing a carboxylic acid group and an amino group at the C5 carbon atom. Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Delta amino acids and derivatives Alpha-amino ketones Amino acids Carboxylic acids Gamma-keto acids and derivatives Hydrocarbon derivatives Monoalkylamines Monocarboxylic acids and derivatives Organic oxides Organopnictogen compounds Short-chain keto acids and derivatives Aliphatic acyclic compound Alpha-aminoketone Amine Amino acid Carbonyl group Carboxylic acid Delta amino acid or derivatives Gamma-keto acid Hydrocarbon derivative Keto acid Ketone Monocarboxylic acid or derivatives Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Primary aliphatic amine Primary amine Short-chain keto acid Aliphatic acyclic compounds 4-oxo monocarboxylic acid Amino fatty acids delta-amino acid Solid melting_point 156 - 158 °C water_solubility 1000 mg/mL at 25 °C logp -2.85 ALOGPS logs 0.12 ALOGPS logp -3.3 ChemAxon pka_strongest_acidic 4.05 ChemAxon pka_strongest_basic 7.84 ChemAxon iupac 5-amino-4-oxopentanoic acid ChemAxon average_mass 131.1299 ChemAxon mono_mass 131.058243159 ChemAxon smiles NCC(=O)CCC(O)=O ChemAxon formula C5H9NO3 ChemAxon inchi InChI=1S/C5H9NO3/c6-3-4(7)1-2-5(8)9/h1-3,6H2,(H,8,9) ChemAxon inchikey ZGXJTSGNIOSYLO-UHFFFAOYSA-N ChemAxon polar_surface_area 80.39 ChemAxon refractivity 30.45 ChemAxon polarizability 12.55 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 4 ChemAxon donor_count 2 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 Glycine and Serine Metabolism SMP0087245 Porphyrin Metabolism SMP0087243 Specdb::MsIr 1103 Specdb::MsIr 1104 Specdb::MsIr 1105 Specdb::NmrTwoD 1591 Specdb::CMs 701 Specdb::CMs 702 Specdb::CMs 703 Specdb::CMs 704 Specdb::CMs 705 Specdb::CMs 706 Specdb::CMs 1427 Specdb::CMs 1457 Specdb::CMs 3255 Specdb::CMs 30332 Specdb::CMs 30333 Specdb::CMs 30457 Specdb::CMs 30458 Specdb::CMs 30917 Specdb::CMs 30918 Specdb::CMs 31281 Specdb::CMs 31282 Specdb::CMs 37948 Specdb::CMs 174789 Specdb::NmrOneD 1650 Specdb::NmrOneD 146630 Specdb::NmrOneD 146631 Specdb::NmrOneD 146632 Specdb::NmrOneD 146633 Specdb::NmrOneD 146634 Specdb::NmrOneD 146635 Specdb::NmrOneD 146636 Specdb::NmrOneD 146637 Specdb::NmrOneD 146638 Specdb::NmrOneD 146639 Specdb::NmrOneD 146640 Specdb::NmrOneD 146641 Specdb::NmrOneD 146642 Specdb::NmrOneD 146643 Specdb::NmrOneD 146644 Specdb::NmrOneD 146645 Specdb::NmrOneD 146646 Specdb::NmrOneD 146647 Specdb::NmrOneD 146648 Specdb::NmrOneD 146649 Specdb::MsMs 1433 Specdb::MsMs 1434 Specdb::MsMs 1435 Specdb::MsMs 5049 Specdb::MsMs 5050 Specdb::MsMs 5051 Specdb::MsMs 5052 Specdb::MsMs 5053 Specdb::MsMs 5060 Specdb::MsMs 5061 Specdb::MsMs 20222 Specdb::MsMs 20223 Specdb::MsMs 20224 Specdb::MsMs 20249 Specdb::MsMs 20250 Specdb::MsMs 20251 Specdb::MsMs 21773 Specdb::MsMs 21774 Specdb::MsMs 21775 Specdb::MsMs 21800 Specdb::MsMs 21801 Specdb::MsMs 21802 Specdb::MsMs 439128 Specdb::MsMs 445596 Specdb::MsMs 445597 Bladder Wishart DS, Feunang YD, Marcu A, Guo AC, Liang K, Vazquez-Fresno R, Sajed T, Johnson D, Li C, Karu N, Sayeeda Z, Lo E, Assempour N, Berjanskii M, Singhal S, Arndt D, Liang Y, Badran H, Grant J, Serra-Cayuela A, Liu Y, Mandal R, Neveu V, Pon A, Knox C, Wilson M, Manach C, Scalbert A: HMDB 4.0: the human metabolome database for 2018. Nucleic Acids Res. 2018 Jan 4;46(D1):D608-D617. doi: 10.1093/nar/gkx1089. 29140435 Epidermis Wishart DS, Feunang YD, Marcu A, Guo AC, Liang K, Vazquez-Fresno R, Sajed T, Johnson D, Li C, Karu N, Sayeeda Z, Lo E, Assempour N, Berjanskii M, Singhal S, Arndt D, Liang Y, Badran H, Grant J, Serra-Cayuela A, Liu Y, Mandal R, Neveu V, Pon A, Knox C, Wilson M, Manach C, Scalbert A: HMDB 4.0: the human metabolome database for 2018. Nucleic Acids Res. 2018 Jan 4;46(D1):D608-D617. doi: 10.1093/nar/gkx1089. 29140435 Fibroblasts Wishart DS, Feunang YD, Marcu A, Guo AC, Liang K, Vazquez-Fresno R, Sajed T, Johnson D, Li C, Karu N, Sayeeda Z, Lo E, Assempour N, Berjanskii M, Singhal S, Arndt D, Liang Y, Badran H, Grant J, Serra-Cayuela A, Liu Y, Mandal R, Neveu V, Pon A, Knox C, Wilson M, Manach C, Scalbert A: HMDB 4.0: the human metabolome database for 2018. Nucleic Acids Res. 2018 Jan 4;46(D1):D608-D617. doi: 10.1093/nar/gkx1089. 29140435 Kidney Wishart DS, Feunang YD, Marcu A, Guo AC, Liang K, Vazquez-Fresno R, Sajed T, Johnson D, Li C, Karu N, Sayeeda Z, Lo E, Assempour N, Berjanskii M, Singhal S, Arndt D, Liang Y, Badran H, Grant J, Serra-Cayuela A, Liu Y, Mandal R, Neveu V, Pon A, Knox C, Wilson M, Manach C, Scalbert A: HMDB 4.0: the human metabolome database for 2018. Nucleic Acids Res. 2018 Jan 4;46(D1):D608-D617. doi: 10.1093/nar/gkx1089. 29140435 Spleen Wishart DS, Feunang YD, Marcu A, Guo AC, Liang K, Vazquez-Fresno R, Sajed T, Johnson D, Li C, Karu N, Sayeeda Z, Lo E, Assempour N, Berjanskii M, Singhal S, Arndt D, Liang Y, Badran H, Grant J, Serra-Cayuela A, Liu Y, Mandal R, Neveu V, Pon A, Knox C, Wilson M, Manach C, Scalbert A: HMDB 4.0: the human metabolome database for 2018. Nucleic Acids Res. 2018 Jan 4;46(D1):D608-D617. doi: 10.1093/nar/gkx1089. 29140435 Testis Wishart DS, Feunang YD, Marcu A, Guo AC, Liang K, Vazquez-Fresno R, Sajed T, Johnson D, Li C, Karu N, Sayeeda Z, Lo E, Assempour N, Berjanskii M, Singhal S, Arndt D, Liang Y, Badran H, Grant J, Serra-Cayuela A, Liu Y, Mandal R, Neveu V, Pon A, Knox C, Wilson M, Manach C, Scalbert A: HMDB 4.0: the human metabolome database for 2018. Nucleic Acids Res. 2018 Jan 4;46(D1):D608-D617. doi: 10.1093/nar/gkx1089. 29140435 FDB022452 134 DB00855 17549 137 C00430 C00007378 5-AMINO-LEVULINATE 34963 Aminolevulinic_acid 6037 Goli?ski J., D?browski Z., Obukowicz B., Kami?ski J., Be?dowicz M., Kwa?ny M.: "Synthesis of 5-aminolevulinic acid (5-ALA)", ICRI Annual Report '99, 2000, 119-122. BMDBP00111 Delta-aminolevulinic acid dehydratase Q2KIL3 ALAD Enzyme BMDBP00112 Delta-aminolevulinic acid dehydratase Q58DK5 ALAD Enzyme BMDBP00624 5-aminolevulinate synthase, nonspecific, mitochondrial A6QLI6 ALAS1 Enzyme BMDBP00629 5-aminolevulinate synthase, erythroid-specific, mitochondrial Q3ZC31 ALAS2 Enzyme BMDBP00681 Cytoplasmic aconitate hydratase Q0VCU1 ACO1 Enzyme