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CHEBI:137915 - Leu-Ser-Glu-Thr-Tyr(SO3H)-Thr-Lys-D-Leu

ChEBI IDCHEBI:137915
ChEBI NameLeu-Ser-Glu-Thr-Tyr(SO3H)-Thr-Lys-D-Leu
Stars
ASCII NameLeu-Ser-Glu-Thr-Tyr(SO3H)-Thr-Lys-D-Leu
DefinitionAn eight-membered oligopeptide comprising L-leucine, L-serine, L-glutamic acid, L-threonine, O-sulfo-L-tyrosine, L-threonine, L-lysine and D-leucine residues coupled in sequence.
Last Modified17 July 2017
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC43H71N9O18S
Net Charge0
Average Mass1034.153
Monoisotopic Mass1033.46378
SMILESCC(C)C[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(OS(=O)(=O)O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@H](CC(C)C)C(=O)O)C(C)O)C(C)O
InChIInChI=1S/C43H71N9O18S/c1-21(2)17-27(45)36(58)50-32(20-53)40(62)46-29(14-15-33(56)57)38(60)51-35(24(6)55)42(64)48-30(19-25-10-12-26(13-11-25)70-71(67,68)69)39(61)52-34(23(5)54)41(63)47-28(9-7-8-16-44)37(59)49-31(43(65)66)18-22(3)4/h10-13,21-24,27-32,34-35,53-55H,7-9,14-20,44-45H2,1-6H3,(H,46,62)(H,47,63)(H,48,64)(H,49,59)(H,50,58)(H,51,60)(H,52,61)(H,56,57)(H,65,66)(H,67,68,69)/t23?,24?,27-,28-,29-,30-,31+,32-,34-,35-/m0/s1
InChIKeyDKEVRDBXGYAMEK-HAWIQPQSSA-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)
Leu-Ser-Glu-Thr-Tyr(SO3H)-Thr-Lys-D-Leu (CHEBI:137915) is a oligopeptide (CHEBI:25676)
IUPAC Name 
L-leucyl-L-seryl-L-α-glutamyl-L-threonyl-O-sulfo-L-tyrosyl-L-threonyl-L-lysyl-D-leucine
Synonym  Source
LSETY(SO3H)TKdLChEBI
Registry NumbersSources
Reaxys:31214078Reaxys
Citations