peginesatide (CHEBI:66889)

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CHEBI:66889 - peginesatide

ChEBI ID	CHEBI:66889
ChEBI Name	peginesatide
Stars
Definition	A heterodetic cyclic peptide composed of two identical 21-amino acid cyclic peptide units covalently bonded via a linker derived from iminodiacetic acid and β-alanine to a lysine-branched poly(ethylene glycol) chain. Used for the treatment of anemia due to chronic kidney disease in patients on dialysis.
Last Modified	19 December 2017
Submitter	Steve
Downloads	Molfile

Formula	2(C2H4O)n.C229H344N62O58S6
Net Charge	0
Average Mass	5174.155
Monoisotopic Mass	5170.47230
SMILES	OCCOC(=O)NCCCC[C@H](NC(=O)OCCO)C(=O)NCCC(=O)N(CC(=O)NCCCC[C@H](NC(=O)CN(C)C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)CNC(C)=O)C(=O)N[C@@H](Cc2cncn2)C(=O)N[C@@H](CCSC)C(=O)NCC(=O)N2CCC[C@H]2C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc2cccc3ccccc23)C(=O)N[C@@H](C(C)C)C(=O)N1)C(N)=O)CC(=O)NCCCC[C@H](NC(=O)CN(C)C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)CNC(C)=O)C(=O)N[C@@H](Cc2cncn2)C(=O)N[C@@H](CCSC)C(=O)NCC(=O)N2CCC[C@H]2C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc2cccc3ccccc23)C(=O)N[C@@H](C(C)C)C(=O)N1)C(N)=O

Wikipedia

Roles Classification

Chemical Role:	Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:	erythropeotin receptor agonist An agonist that binds to and activates erythropeotin receptors.

ChEBI Ontology

Outgoing Relation(s)
	peginesatide (CHEBI:66889) has role erythropeotin receptor agonist (CHEBI:66894)
	peginesatide (CHEBI:66889) is a heterodetic cyclic peptide (CHEBI:24533)
	peginesatide (CHEBI:66889) is a poly(ethylene glycol) derivative (CHEBI:139322)
	peginesatide (CHEBI:66889) is conjugate base of peginesatide(2+) (CHEBI:66897)
Incoming Relation(s)
Incoming Relation(s)	peginesatide(2+) (CHEBI:66897) is conjugate acid of peginesatide (CHEBI:66889)

INN	Source
peginesatide	KEGG DRUG

Synonym	Source
N(sup 6.21),N(sup 6.21')-(((N(sup 2),N(sup 6)-bis((omega-methoxypoly(oxyethylene))carbonyl)-L-lysyl-beta-alanyl)imino)bis(methylenecarbonyl))bis(acetylglycylglycyl-L-leucyl-L-tyrosyl-L-alanyl-L-cysteinyl-L-histidyl-L-methionylglycyl-L-prolyl-L-isoleucyl-L-threonyl-3-(naphthalen-1-yl)-L-alanyl-L-valyl-L-cysteinyl-L-glutaminyl-L-prolyl-L-leucyl-L-arginyl-N-methylglycyl-L-lysinamide) cyclic (6-15:6'-15')-bisdisulfide	ChemIDplus

Synonym

Source

N(sup 6.21),N(sup 6.21')-(((N(sup 2),N(sup 6)-bis((omega-methoxypoly(oxyethylene))carbonyl)-L-lysyl-beta-alanyl)imino)bis(methylenecarbonyl))bis(acetylglycylglycyl-L-leucyl-L-tyrosyl-L-alanyl-L-cysteinyl-L-histidyl-L-methionylglycyl-L-prolyl-L-isoleucyl-L-threonyl-3-(naphthalen-1-yl)-L-alanyl-L-valyl-L-cysteinyl-L-glutaminyl-L-prolyl-L-leucyl-L-arginyl-N-methylglycyl-L-lysinamide) cyclic (6-15:6'-15')-bisdisulfide

ChemIDplus

Manual Xrefs	Databases
D09946	KEGG DRUG
Peginesatide	Wikipedia

Registry Numbers	Sources
CAS:913976-27-9	KEGG DRUG

Citations