CHEBI:133068 - [des-Arg⁹]-bradykinin

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ChEBI Name [des-Arg9]-bradykinin ChEBI ID CHEBI:133068 ChEBI ASCII Name [des-Arg(9)]-bradykinin Definition An eight-membered oligopeptide comprising Arg, Pro, Pro, Gly, Phe, Ser, Pro and Phe residues joined in sequence. It is an analogue of bradykinin lacking the Arg residue at position 9. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information ChemicalBook:CB1707690, eMolecules:6842976, ZINC000169289405 Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C44H61N11O10 Net Charge 0 Average Mass 904.025 Monoisotopic Mass 903.46029 InChI InChI=1S/C44H61N11O10/c45-29(15-7-19-48-44(46)47)40(61)55-22-10-18-35(55)42(63)54-21-8-16-33(54)38(59)49-25-36(57)50-30(23-27-11-3-1-4-12-27)37(58)52-32(26-56)41(62)53-20-9-17-34(53)39(60)51-31(43(64)65)24-28-13-5-2-6-14-28/h1-6,11-14,29-35,56H,7-10,15-26,45H2,(H,49,59)(H,50,57)(H,51,60)(H,52,58)(H,64,65)(H4,46,47,48)/t29-,30-,31-,32-,33-,34-,35-/m0/s1 InChIKey VCEHWDBVPZFHAG-POFDKVPJSA-N SMILES C(=N)(NCCC[C@@H](C(=O)N1[C@H](C(N2[C@H](C(=O)NCC(N[C@H](C(N[C@H](C(=O)N3[C@H](C(=O)N[C@H](C(O)=O)CC=4C=CC=CC4)CCC3)CO)=O)CC=5C=CC=CC5)=O)CCC2)=O)CCC1)N)N Roles Classification Chemical Role(s): Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) Biological Role(s): bradykinin receptor B2 agonist A bradykinin agonist that binds to and activates bradykinin B2 receptors. View more via ChEBI Ontology ChEBI Ontology Outgoing [des-Arg9]-bradykinin (CHEBI:133068) has role bradykinin receptor B2 agonist (CHEBI:77496) [des-Arg9]-bradykinin (CHEBI:133068) is a oligopeptide (CHEBI:25676) [des-Arg9]-bradykinin (CHEBI:133068) is conjugate base of [des-Arg9]-bradykinin(1+) (CHEBI:133069) Incoming [des-Arg9]-bradykinin(1+) (CHEBI:133069) is conjugate acid of [des-Arg9]-bradykinin (CHEBI:133068) IUPAC Name L-arginyl-L-prolyl-L-prolylglycyl-L-phenylalanyl-L-seryl-L-prolyl-L-phenylalanine Synonyms Sources 1-8-Bradykinin ChemIDplus 9-De-arg-bradykinin ChemIDplus 9-de-L-Argininebradykinin ChemIDplus 9-Des-arg-BK ChemIDplus Arg-Pro-Pro-Gly-Phe-Ser-Pro-Phe ChEBI Bradykinin, des-arg(9) ChemIDplus Des-arg(9)-bradykinin ChemIDplus L-Arg-L-Pro-L-Pro-Gly-L-Phe-L-Ser-L-Pro-L-Phe ChEBI RPPGFSPF ChEBI Registry Numbers Types Sources 10326223 Reaxys Registry Number Reaxys 15958-92-6 CAS Registry Number ChemIDplus 4228002 Reaxys Registry Number Reaxys Citations Last Modified 18 August 2016