1.0 2011-09-21 00:19:53 UTC 2015-07-21 06:57:22 UTC FDB022806 DOPA sulfate Increases in plasma dopamine sulfate and urinary dopamine suggest that dopamine sulfate may be generated via DOPA sulfate and urinary dopamine may originate from circulating DOPA. DOPA sulfate may be an alternative source of dopamine sulfate. Urinary dopamine progressively increased in the course of metyrosine treatment, and this, along with the increase of the dopamine metabolite, dihydroxyphenylethanol, and plasma dopamine sulfate, occurred in the absence of any change in plasma dopamine.(PMID: 1969915) [HMDB] 3-(3-sulfo-4-hydroxy-phenyl)-L-alanine 3-(sulfooxy)-L-Tyrosine 3,4-dihydroxy-L-phenylalanine 3-O-sulfate 3,4-Dihydroxy-L-phenylalanine 3-O-sulphate DOPA Sulfate L-3-hydroxytyrosine 3-sulfate L-3-Hydroxytyrosine 3-sulphate L-3,4-dihydroxyphenylalanine sulfate L-3,4-Dihydroxyphenylalanine sulphate L-dopa 3-O-sulfate L-Dopa 3-O-sulphate C9H11NO7S 277.251 277.025622401 (2S)-2-amino-3-[4-hydroxy-3-(sulfooxy)phenyl]propanoic acid 3-(sulfooxy)-L-tyrosine 96253-55-3 N[C@@H](CC1=CC(OS(O)(=O)=O)=C(O)C=C1)C(O)=O InChI=1S/C9H11NO7S/c10-6(9(12)13)3-5-1-2-7(11)8(4-5)17-18(14,15)16/h1-2,4,6,11H,3,10H2,(H,12,13)(H,14,15,16)/t6-/m0/s1 SWJDFMNJUOJVPA-LURJTMIESA-N belongs to the class of organic compounds known as tyrosine and derivatives. Tyrosine and derivatives are compounds containing tyrosine or a derivative thereof resulting from reaction of tyrosine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom. Tyrosine and derivatives Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Aromatic homomonocyclic compounds 1-hydroxy-2-unsubstituted benzenoids Amino acids Amphetamines and derivatives Aralkylamines Carbonyl compounds Carboxylic acids Hydrocarbon derivatives L-alpha-amino acids Monoalkylamines Monocarboxylic acids and derivatives Organic oxides Organopnictogen compounds Phenoxy compounds Phenylalanine and derivatives Phenylpropanoic acids Phenylsulfates Sulfuric acid monoesters 1-hydroxy-2-unsubstituted benzenoid 3-phenylpropanoic-acid Alpha-amino acid Amine Amino acid Amphetamine or derivatives Aralkylamine Aromatic homomonocyclic compound Arylsulfate Benzenoid Carbonyl group Carboxylic acid Hydrocarbon derivative L-alpha-amino acid Monocarboxylic acid or derivatives Monocyclic benzene moiety Organic nitrogen compound Organic oxide Organic oxygen compound Organic sulfuric acid or derivatives Organonitrogen compound Organooxygen compound Organopnictogen compound Phenol Phenoxy compound Phenylalanine or derivatives Phenylsulfate Primary aliphatic amine Primary amine Sulfate-ester Sulfuric acid ester Sulfuric acid monoester Tyrosine or derivatives Solid logp -1.92 ALOGPS logs -2.01 ALOGPS solubility 2.73e+00 g/l ALOGPS logp -0.4 ChemAxon pka_strongest_acidic -2.2 ChemAxon pka_strongest_basic 9.37 ChemAxon iupac (2S)-2-amino-3-[4-hydroxy-3-(sulfooxy)phenyl]propanoic acid ChemAxon average_mass 277.251 ChemAxon mono_mass 277.025622401 ChemAxon smiles N[C@@H](CC1=CC(OS(O)(=O)=O)=C(O)C=C1)C(O)=O ChemAxon formula C9H11NO7S ChemAxon inchi InChI=1S/C9H11NO7S/c10-6(9(12)13)3-5-1-2-7(11)8(4-5)17-18(14,15)16/h1-2,4,6,11H,3,10H2,(H,12,13)(H,14,15,16)/t6-/m0/s1 ChemAxon inchikey SWJDFMNJUOJVPA-LURJTMIESA-N ChemAxon polar_surface_area 147.15 ChemAxon refractivity 59.07 ChemAxon polarizability 24.11 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 7 ChemAxon donor_count 4 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 23524 Specdb::CMs 38232 Specdb::CMs 174093 Specdb::MsMs 66876 Specdb::MsMs 66877 Specdb::MsMs 66878 Specdb::MsMs 124557 Specdb::MsMs 124558 Specdb::MsMs 124559 Specdb::MsMs 3056621 Specdb::MsMs 3056622 Specdb::MsMs 3056623 Specdb::MsMs 3111197 Specdb::MsMs 3111198 Specdb::MsMs 3111199 HMDB02028 #<Reference:0x000055ce317cdf08> #<Reference:0x000055ce317cdd50> Anatidae Type 1 specific Anatidae 8830 Beefalo Type 1 specific Bos taurus X Bison bison 297284 Bison Type 1 specific Bison bison 9901 Buffalo Type 1 specific Bubalus bubalis 89462 Cattle (Beef, Veal) Type 1 specific Bos taurus 9913 Chicken Type 1 specific Gallus gallus 9031 Columbidae (Dove, Pigeon) Type 1 specific Columbidae 8930 Deer Type 1 specific Cervidae 9850 Domestic goat Type 1 specific Capra aegagrus hircus 9925 Domestic pig Type 1 specific Sus scrofa domestica 9825 Elk Type 1 specific Cervus canadensis 1574408 Emu Type 1 specific Dromaius novaehollandiae 8790 European rabbit Type 1 specific Oryctolagus 9984 Greylag goose Type 1 specific Anser anser 8843 Guinea hen Type 1 specific Numida meleagris 8996 Horse Type 1 specific Equus caballus 9796 Mallard duck Type 1 specific Anas platyrhynchos 8839 Mountain hare Type 1 specific Lepus timidus 62621 Mule deer Type 1 specific Odocoileus 9871 Ostrich Type 1 specific Struthio camelus 8801 Pheasant Type 1 specific Phasianus colchicus 9054 Quail Type 1 specific Phasianidae 9005 Rabbit Type 1 specific Leporidae 9979 Rock ptarmigan Type 1 specific Lagopus muta 64668 Sheep (Mutton, Lamb) Type 1 specific Ovis aries 9940 Squab Type 1 specific Columba 8931 Turkey Type 1 specific Meleagris gallopavo 9103 Velvet duck Type 1 specific Melanitta fusca 371864 Wild boar Type 1 specific Sus scrofa 9823