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CHEBI:138805 - Ala-Arg-Gly-Tyr-Ser-Ser-Phe-Ile-Tyr-Trp-Phe-Phe

ChEBI IDCHEBI:138805
ChEBI NameAla-Arg-Gly-Tyr-Ser-Ser-Phe-Ile-Tyr-Trp-Phe-Phe
Stars
DefinitionAn oligopeptide composed of L-alanine, L-arginine, glycine, L-tyrosine, L-serine, L-serine, L-phenylalanine, L-isoleucine, L-tyrosine, L-trytophan, L-phenylalanine and L-phenylalanine joined in sequence by peptide linkages.
Last Modified23 October 2017
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC79H98N16O17
Net Charge0
Average Mass1543.748
Monoisotopic Mass1542.72959
SMILESCCC(C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
InChIInChI=1S/C79H98N16O17/c1-4-45(2)67(77(110)91-60(38-51-28-32-54(99)33-29-51)71(104)90-62(40-52-41-84-56-24-15-14-23-55(52)56)73(106)88-59(35-47-17-8-5-9-18-47)72(105)92-63(78(111)112)39-49-21-12-7-13-22-49)95-74(107)61(36-48-19-10-6-11-20-48)89-75(108)64(43-96)94-76(109)65(44-97)93-70(103)58(37-50-26-30-53(98)31-27-50)86-66(100)42-85-69(102)57(87-68(101)46(3)80)25-16-34-83-79(81)82/h5-15,17-24,26-33,41,45-46,57-65,67,84,96-99H,4,16,25,34-40,42-44,80H2,1-3H3,(H,85,102)(H,86,100)(H,87,101)(H,88,106)(H,89,108)(H,90,104)(H,91,110)(H,92,105)(H,93,103)(H,94,109)(H,95,107)(H,111,112)(H4,81,82,83)/t45?,46-,57-,58-,59-,60-,61-,62-,63-,64-,65-,67-/m0/s1
InChIKeyWKQLJWDFCOOIFF-SIMXMABKSA-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)
Ala-Arg-Gly-Tyr-Ser-Ser-Phe-Ile-Tyr-Trp-Phe-Phe (CHEBI:138805) is a oligopeptide (CHEBI:25676)
IUPAC Name 
L-alanyl-L-arginylglycyl-L-tyrosyl-L-seryl-L-seryl-L-phenylalanyl-L-isoleucyl-L-tyrosyl-L-tryptophyl-L-phenylalanyl-L-phenylalanine
Synonyms  Source
A R G Y S S F I Y W F FJCBN
ARGYSSFIYWFFChEBI
Citations