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CHEBI:71532 - N2-[acetamido(1H-imidazol-4-yl)acetyl]-L-Glu-L-Ser-Gly-L-Pro-L-Val-NH2

ChEBI IDCHEBI:71532
ChEBI NameN2-[acetamido(1H-imidazol-4-yl)acetyl]-L-Glu-L-Ser-Gly-L-Pro-L-Val-NH2
Stars
ASCII NameN(2)-[acetamido(1H-imidazol-4-yl)acetyl]-L-Glu-L-Ser-Gly-L-Pro-L-Val-NH2
DefinitionA pentapeptide comprised of N2-[acetamido(1H-imidazol-4-yl)acetyl]-L-glutamine, L-serine, glycine, L-proline and L-valinamide residues coupled in sequence.
Last Modified4 January 2013
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC27H42N10O9
Net Charge0
Average Mass650.694
Monoisotopic Mass650.31362
SMILESCC(=O)NC(C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@H](C(N)=O)C(C)C)c1cncn1
InChIInChI=1S/C27H42N10O9/c1-13(2)21(23(29)42)36-26(45)18-5-4-8-37(18)20(41)10-31-24(43)17(11-38)35-25(44)15(6-7-19(28)40)34-27(46)22(33-14(3)39)16-9-30-12-32-16/h9,12-13,15,17-18,21-22,38H,4-8,10-11H2,1-3H3,(H2,28,40)(H2,29,42)(H,30,32)(H,31,43)(H,33,39)(H,34,46)(H,35,44)(H,36,45)/t15-,17-,18-,21-,22?/m0/s1
InChIKeyKVRPBYJDMPIPAL-AAGVKZCPSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
N2-[acetamido(1H-imidazol-4-yl)acetyl]-L-Glu-L-Ser-Gly-L-Pro-L-Val-NH2 (CHEBI:71532) is a pentapeptide (CHEBI:48545)
IUPAC Name 
N2-[acetamido(1H-imidazol-4-yl)acetyl]-L-glutaminyl-L-serylglycyl-L-prolyl-L-valinamide
Citations