1.0 2010-04-08 22:13:06 UTC 2019-11-26 03:14:54 UTC FDB017467 Ornithokinin Isolated from chicken blood. Ornithokinin is found in animal foods. 6-L-Threonine-8-L-leucine-bradykinin 6-L-Threonine-8-L-leucinebradykinin 6-Thr-8-leu-bradykinin Arg-pro-pro-GLY-phe-THR-pro-leu-arg Bradykinin, 6-L-threonine-8-L-leucine- Bradykinin, thr(6)-leu(8)- Bradykinin, threonyl(6)-leucyl(8)- Ornitho-kinin Thr(6)-leu(8)-bradykinin Threonyl(6)-leucyl(8)-bradykinin C48H77N15O11 1040.2189 1039.592698381 (2S)-2-[(Z)-[(2S)-2-[(Z)-{[(2S)-1-[(2S,3R)-2-[(Z)-[(2S)-2-[(Z)-{2-[(Z)-{[(2S)-1-[(2S)-1-[(2S)-2-amino-5-carbamimidamidopentanoyl]pyrrolidine-2-carbonyl]pyrrolidin-2-yl](hydroxy)methylidene}amino]-1-hydroxyethylidene}amino]-1-hydroxy-3-phenylpropylidene]amino]-3-hydroxybutanoyl]pyrrolidin-2-yl](hydroxy)methylidene}amino]-1-hydroxy-4-methylpentylidene]amino]-5-carbamimidamidopentanoic acid (2S)-2-[(Z)-[(2S)-2-[(Z)-{[(2S)-1-[(2S,3R)-2-[(Z)-[(2S)-2-[(Z)-{2-[(Z)-{[(2S)-1-[(2S)-1-[(2S)-2-amino-5-carbamimidamidopentanoyl]pyrrolidine-2-carbonyl]pyrrolidin-2-yl](hydroxy)methylidene}amino]-1-hydroxyethylidene}amino]-1-hydroxy-3-phenylpropylidene]amino]-3-hydroxybutanoyl]pyrrolidin-2-yl](hydroxy)methylidene}amino]-1-hydroxy-4-methylpentylidene]amino]-5-carbamimidamidopentanoic acid 14042-92-3 CC(C)C[C@H](\N=C(/O)[C@@H]1CCCN1C(=O)[C@@H](\N=C(/O)[C@H](CC1=CC=CC=C1)\N=C(/O)C\N=C(/O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(N)=N)[C@@H](C)O)C(\O)=N\[C@@H](CCCNC(N)=N)C(O)=O InChI=1S/C48H77N15O11/c1-27(2)24-32(39(66)58-31(46(73)74)15-8-20-55-48(52)53)59-42(69)35-17-10-22-62(35)45(72)38(28(3)64)60-40(67)33(25-29-12-5-4-6-13-29)57-37(65)26-56-41(68)34-16-9-21-61(34)44(71)36-18-11-23-63(36)43(70)30(49)14-7-19-54-47(50)51/h4-6,12-13,27-28,30-36,38,64H,7-11,14-26,49H2,1-3H3,(H,56,68)(H,57,65)(H,58,66)(H,59,69)(H,60,67)(H,73,74)(H4,50,51,54)(H4,52,53,55)/t28-,30+,31+,32+,33+,34+,35+,36+,38+/m1/s1 ASWVOLDXJJGVLP-JZFIHROJSA-N belongs to the class of organic compounds known as oligopeptides. These are organic compounds containing a sequence of between three and ten alpha-amino acids joined by peptide bonds. Oligopeptides Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Aromatic heteromonocyclic compounds Alpha amino acid amides Amino acids Amphetamines and derivatives Azacyclic compounds Carbonyl compounds Carboximidamides Carboxylic acids Guanidines Hydrocarbon derivatives Leucine and derivatives Monoalkylamines Monocarboxylic acids and derivatives N-acyl amines N-acyl-L-alpha-amino acids N-acylpyrrolidines Organic oxides Organopnictogen compounds Phenylalanine and derivatives Proline and derivatives Propargyl-type 1,3-dipolar organic compounds Pyrrolidinecarboxamides Secondary alcohols Secondary carboxylic acid amides Tertiary carboxylic acid amides Alcohol Alpha-amino acid amide Alpha-amino acid or derivatives Alpha-oligopeptide Amine Amino acid Amino acid or derivatives Amphetamine or derivatives Aromatic heteromonocyclic compound Azacycle Benzenoid Carbonyl group Carboxamide group Carboximidamide Carboxylic acid Fatty acyl Fatty amide Guanidine Hydrocarbon derivative Leucine or derivatives Monocarboxylic acid or derivatives Monocyclic benzene moiety N-acyl-alpha amino acid or derivatives N-acyl-alpha-amino acid N-acyl-amine N-acyl-l-alpha-amino acid N-acylpyrrolidine N-substituted-alpha-amino acid Organic 1,3-dipolar compound Organic nitrogen compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organonitrogen compound Organooxygen compound Organopnictogen compound Phenylalanine or derivatives Primary aliphatic amine Primary amine Proline or derivatives Propargyl-type 1,3-dipolar organic compound Pyrrolidine Pyrrolidine carboxylic acid or derivatives Pyrrolidine-2-carboxamide Secondary alcohol Secondary carboxylic acid amide Tertiary carboxylic acid amide logp -0.69 ALOGPS logs -3.99 ALOGPS solubility 1.06e-01 g/l ALOGPS logp -3.7 ChemAxon pka_strongest_acidic 3.51 ChemAxon pka_strongest_basic 12.35 ChemAxon iupac (2S)-2-[(Z)-[(2S)-2-[(Z)-{[(2S)-1-[(2S,3R)-2-[(Z)-[(2S)-2-[(Z)-{2-[(Z)-{[(2S)-1-[(2S)-1-[(2S)-2-amino-5-carbamimidamidopentanoyl]pyrrolidine-2-carbonyl]pyrrolidin-2-yl](hydroxy)methylidene}amino]-1-hydroxyethylidene}amino]-1-hydroxy-3-phenylpropylidene]amino]-3-hydroxybutanoyl]pyrrolidin-2-yl](hydroxy)methylidene}amino]-1-hydroxy-4-methylpentylidene]amino]-5-carbamimidamidopentanoic acid ChemAxon average_mass 1040.2189 ChemAxon mono_mass 1039.592698381 ChemAxon smiles CC(C)C[C@H](\N=C(/O)[C@@H]1CCCN1C(=O)[C@@H](\N=C(/O)[C@H](CC1=CC=CC=C1)\N=C(/O)C\N=C(/O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(N)=N)[C@@H](C)O)C(\O)=N\[C@@H](CCCNC(N)=N)C(O)=O ChemAxon formula C48H77N15O11 ChemAxon inchi InChI=1S/C48H77N15O11/c1-27(2)24-32(39(66)58-31(46(73)74)15-8-20-55-48(52)53)59-42(69)35-17-10-22-62(35)45(72)38(28(3)64)60-40(67)33(25-29-12-5-4-6-13-29)57-37(65)26-56-41(68)34-16-9-21-61(34)44(71)36-18-11-23-63(36)43(70)30(49)14-7-19-54-47(50)51/h4-6,12-13,27-28,30-36,38,64H,7-11,14-26,49H2,1-3H3,(H,56,68)(H,57,65)(H,58,66)(H,59,69)(H,60,67)(H,73,74)(H4,50,51,54)(H4,52,53,55)/t28-,30+,31+,32+,33+,34+,35+,36+,38+/m1/s1 ChemAxon inchikey ASWVOLDXJJGVLP-JZFIHROJSA-N ChemAxon polar_surface_area 431.23 ChemAxon refractivity 291.17 ChemAxon polarizability 111.73 ChemAxon rotatable_bond_count 27 ChemAxon acceptor_count 23 ChemAxon donor_count 14 ChemAxon physiological_charge 2 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 93780 Specdb::MsMs 93781 Specdb::MsMs 93782 Specdb::MsMs 157623 Specdb::MsMs 157624 Specdb::MsMs 157625 Specdb::MsMs 2726726 Specdb::MsMs 2726727 Specdb::MsMs 2726728 Specdb::MsMs 2979518 Specdb::MsMs 2979519 Specdb::MsMs 2979520 Specdb::NmrOneD 25202 Specdb::NmrOneD 25203 Specdb::NmrOneD 25204 Specdb::NmrOneD 25205 Specdb::NmrOneD 25206 Specdb::NmrOneD 25207 Specdb::NmrOneD 25208 Specdb::NmrOneD 25209 Specdb::NmrOneD 25210 Specdb::NmrOneD 25211 Specdb::NmrOneD 25212 Specdb::NmrOneD 25213 Specdb::NmrOneD 25214 Specdb::NmrOneD 25215 Specdb::NmrOneD 25216 Specdb::NmrOneD 25217 Specdb::NmrOneD 25218 Specdb::NmrOneD 25219 Specdb::NmrOneD 25220 Specdb::NmrOneD 25221 HMDB38224 #<Reference:0x000055ce30612f20> #<Reference:0x000055ce30612ca0> #<Reference:0x000055ce30612ac0> #<Reference:0x000055ce30612908> #<Reference:0x000055ce30612750> #<Reference:0x000055ce30612598>