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CHEBI:62365 - Ac-Cha-Arg-Ala-Met-Cys(Acm)-Ser-Leu-NH2

ChEBI IDCHEBI:62365
ChEBI NameAc-Cha-Arg-Ala-Met-Cys(Acm)-Ser-Leu-NH2
Stars
ASCII NameAc-Cha-Arg-Ala-Met-Cys(Acm)-Ser-Leu-NH2
DefinitionA seven-membered oligopeptide comprising Ac-Cha, Arg, Ala, Met, Cys(Acm), Ser and Leu-NH2 residues coupled in sequence.
Last Modified17 June 2011
SubmitterSteve
DownloadsMolfile
FormulaC40H72N12O10S2
Net Charge0
Average Mass945.224
Monoisotopic Mass944.49358
SMILESCSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC1CCCCC1)NC(C)=O)C(=O)N[C@@H](CSCNC(C)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(N)=O
InChIInChI=1S/C40H72N12O10S2/c1-22(2)17-29(33(41)56)50-38(61)31(19-53)51-39(62)32(20-64-21-45-24(4)54)52-36(59)28(14-16-63-6)48-34(57)23(3)46-35(58)27(13-10-15-44-40(42)43)49-37(60)30(47-25(5)55)18-26-11-8-7-9-12-26/h22-23,26-32,53H,7-21H2,1-6H3,(H2,41,56)(H,45,54)(H,46,58)(H,47,55)(H,48,57)(H,49,60)(H,50,61)(H,51,62)(H,52,59)(H4,42,43,44)/t23-,27-,28-,29-,30-,31-,32-/m0/s1
InChIKeyKHCSMHYTMQUQCE-HVEPFCGMSA-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)
Ac-Cha-Arg-Ala-Met-Cys(Acm)-Ser-Leu-NH2 (CHEBI:62365) is a oligopeptide (CHEBI:25676)
IUPAC Name 
N-acetyl-3-cyclohexyl-L-alanyl-L-arginyl-L-alanyl-L-methionyl-S-(acetamidomethyl)-L-cysteinyl-L-seryl-L-leucinamide
Synonyms  Source
Ac-(Cha)RAM(CAcm)SL-NH2ChEBI
Ac(Cha)ArgAlaMetCys(Acm)SerLeuNH2ChEBI
Citations