1.0 2020-03-03 19:41:11 UTC 2020-04-22 15:57:08 UTC BMDB0064107 BMDB64107 Tryptophyl-Tyrosine L-Tryptophyl-L-tyrosine TRP-Tyr Tryptophan tyrosine dipeptide Tryptophan-tyrosine dipeptide Tryptophyltyrosine W-Y dipeptide WY dipeptide 2-{[2-amino-1-hydroxy-3-(1H-indol-3-yl)propylidene]amino}-3-(4-hydroxyphenyl)propanoate Tryptophyl-tyrosine C20H21N3O4 367.3984 367.153206175 2-[2-amino-3-(1H-indol-3-yl)propanamido]-3-(4-hydroxyphenyl)propanoic acid trp-tyr NC(CC1=CNC2=C1C=CC=C2)C(=O)NC(CC1=CC=C(O)C=C1)C(O)=O InChI=1S/C20H21N3O4/c21-16(10-13-11-22-17-4-2-1-3-15(13)17)19(25)23-18(20(26)27)9-12-5-7-14(24)8-6-12/h1-8,11,16,18,22,24H,9-10,21H2,(H,23,25)(H,26,27) TYYLDKGBCJGJGW-UHFFFAOYSA-N belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Dipeptides 1-hydroxy-2-unsubstituted benzenoids 3-alkylindoles Alpha amino acid amides Amino acids Amphetamines and derivatives Aralkylamines Azacyclic compounds Carbonyl compounds Carboxylic acids Fatty amides Heteroaromatic compounds Hydrocarbon derivatives Monoalkylamines Monocarboxylic acids and derivatives N-acyl-alpha amino acids Organic oxides Organopnictogen compounds Phenylalanine and derivatives Phenylpropanoic acids Secondary carboxylic acid amides Substituted pyrroles Tryptamines and derivatives Tyrosine and derivatives 1-hydroxy-2-unsubstituted benzenoid 3-alkylindole 3-phenylpropanoic-acid Alpha-amino acid amide Alpha-amino acid or derivatives Alpha-dipeptide Amine Amino acid Amino acid or derivatives Amphetamine or derivatives Aralkylamine Aromatic heteropolycyclic compound Azacycle Benzenoid Carbonyl group Carboxamide group Carboxylic acid Fatty acyl Fatty amide Heteroaromatic compound Hydrocarbon derivative Indole Indole or derivatives Monocarboxylic acid or derivatives Monocyclic benzene moiety N-acyl-alpha amino acid or derivatives N-acyl-alpha-amino acid Organic nitrogen compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organonitrogen compound Organooxygen compound Organopnictogen compound Phenol Phenylalanine or derivatives Primary aliphatic amine Primary amine Pyrrole Secondary carboxylic acid amide Substituted pyrrole Triptan Tyrosine or derivatives Aromatic heteropolycyclic compounds logp -0.27 ALOGPS logs -3.84 ALOGPS logp -0.27 ChemAxon pka_strongest_acidic 3.56 ChemAxon pka_strongest_basic 7.95 ChemAxon iupac 2-[2-amino-3-(1H-indol-3-yl)propanamido]-3-(4-hydroxyphenyl)propanoic acid ChemAxon average_mass 367.3984 ChemAxon mono_mass 367.153206175 ChemAxon smiles NC(CC1=CNC2=C1C=CC=C2)C(=O)NC(CC1=CC=C(O)C=C1)C(O)=O ChemAxon formula C20H21N3O4 ChemAxon inchi InChI=1S/C20H21N3O4/c21-16(10-13-11-22-17-4-2-1-3-15(13)17)19(25)23-18(20(26)27)9-12-5-7-14(24)8-6-12/h1-8,11,16,18,22,24H,9-10,21H2,(H,23,25)(H,26,27) ChemAxon inchikey TYYLDKGBCJGJGW-UHFFFAOYSA-N ChemAxon polar_surface_area 128.44 ChemAxon refractivity 100.1 ChemAxon polarizability 38.12 ChemAxon rotatable_bond_count 7 ChemAxon acceptor_count 5 ChemAxon donor_count 5 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon number_of_rings 3 ChemAxon bioavailability 1 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::CMs 10023 Specdb::CMs 41127 Specdb::CMs 131661 Specdb::CMs 139395 Specdb::MsMs 288133 Specdb::MsMs 288134 Specdb::MsMs 288135 Specdb::MsMs 327157 Specdb::MsMs 327158 Specdb::MsMs 327159 Specdb::MsMs 2755153 Specdb::MsMs 2755154 Specdb::MsMs 2755155 Specdb::MsMs 2953806 Specdb::MsMs 2953807 Specdb::MsMs 2953808 Specdb::NmrOneD 107878 Specdb::NmrOneD 107879 Specdb::NmrOneD 107880 Specdb::NmrOneD 107881 Specdb::NmrOneD 107882 Specdb::NmrOneD 107883 Specdb::NmrOneD 107884 Specdb::NmrOneD 107885 Specdb::NmrOneD 107886 Specdb::NmrOneD 107887 Specdb::NmrOneD 107888 Specdb::NmrOneD 107889 Specdb::NmrOneD 107890 Specdb::NmrOneD 107891 Specdb::NmrOneD 107892 Specdb::NmrOneD 107893 Specdb::NmrOneD 107894 Specdb::NmrOneD 107895 Specdb::NmrOneD 107896 Specdb::NmrOneD 107897 FDB112099 10443703 13783081