CHEBI:133051 - [Hyp3]-bradykinin

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ChEBI Name [Hyp3]-bradykinin
ChEBI ID CHEBI:133051
ChEBI ASCII Name [Hyp(3)]-bradykinin
Definition An oligopeptide that is an analogue of bradykinin in which the third amino acid, proline, is replaced with hydroxyproline.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C50H73N15O12
Net Charge 0
Average Mass 1076.210
Monoisotopic Mass 1075.55631
InChI InChI=1S/C50H73N15O12/c51-32(15-7-19-56-49(52)53)45(73)64-22-10-18-38(64)47(75)65-27-31(67)25-39(65)43(71)58-26-40(68)59-34(23-29-11-3-1-4-12-29)41(69)62-36(28-66)46(74)63-21-9-17-37(63)44(72)61-35(24-30-13-5-2-6-14-30)42(70)60-33(48(76)77)16-8-20-57-50(54)55/h1-6,11-14,31-39,66-67H,7-10,15-28,51H2,(H,58,71)(H,59,68)(H,60,70)(H,61,72)(H,62,69)(H,76,77)(H4,52,53,56)(H4,54,55,57)/t31-,32+,33+,34+,35+,36+,37+,38+,39+/m1/s1
InChIKey JXRLHZCEMXTCBN-DIBGMJQNSA-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(N[C@H](C(O)=O)CCCNC(=N)N)=O)CC=4C=CC=CC4)CCC3)CO)=O)CC=5C=CC=CC5)=O)C[C@H](C2)O)=O)CCC1)N)N
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in urine (BTO:0001419). See: PubMed
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 agonist
An agonist that binds to and activates bradykinin receptors
human urinary metabolite
Any metabolite (endogenous or exogenous) found in human urine samples.
hormone
Originally referring to an endogenous compound that is formed in specialized organ or group of cells and carried to another organ or group of cells, in the same organism, upon which it has a specific regulatory function, the term is now commonly used to include non-endogenous, semi-synthetic and fully synthetic analogues of such compounds.
(via peptide hormone )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing [Hyp3]-bradykinin (CHEBI:133051) has functional parent bradykinin (CHEBI:3165)
[Hyp3]-bradykinin (CHEBI:133051) has role bradykinin receptor agonist (CHEBI:77495)
[Hyp3]-bradykinin (CHEBI:133051) has role human urinary metabolite (CHEBI:84087)
[Hyp3]-bradykinin (CHEBI:133051) is a oligopeptide (CHEBI:25676)
[Hyp3]-bradykinin (CHEBI:133051) is a peptide hormone (CHEBI:25905)
[Hyp3]-bradykinin (CHEBI:133051) is conjugate base of [Hyp3]-bradykinin(2+) (CHEBI:133054)
Incoming [Hyp3]-bradykinin(2+) (CHEBI:133054) is conjugate acid of [Hyp3]-bradykinin (CHEBI:133051)
IUPAC Name
L-arginyl-L-prolyl-(4R)-4-hydroxy-L-prolylglycyl-L-phenylalanyl-L-seryl-L-prolyl-L-phenylalanyl-L-arginine
Synonyms Sources
3-(L-4-Hydroxyproline)bradykinin HMDB
3-Hydroxy-pro-bradykinin HMDB
Arg-3-hyp-bradykinin ChemIDplus
Arg-Pro-Hyp-Gly-Phe-Ser-Pro-Phe-Arg ChEBI
bradykinin hydroxy-pro(3) ChEBI
Bradykinin hydroxyproline HMDB
Bradykinin, hydroxy-pro(3) ChemIDplus
Hydroxy-pro(3)-bradykinin HMDB
Hydroxyproline(3)-bradykinin HMDB
L-Arg-L-Pro-L-Hyp-Gly-L-Phe-L-Ser-L-Pro-L-Phe-L-Arg ChEBI
Manual Xref Database
HMDB0011728 HMDB
View more database links
Registry Numbers Types Sources
24161146 Reaxys Registry Number Reaxys
37642-65-2 CAS Registry Number ChemIDplus
8471700 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
2156727 PubMed citation Europe PMC
Last Modified
17 August 2016