CHEBI:60965 - Ac-Cha-Arg-Tic-Met-NH2

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ChEBI Name Ac-Cha-Arg-Tic-Met-NH2
ChEBI ID CHEBI:60965
ChEBI ASCII Name Ac-Cha-Arg-Tic-Met-NH2
Definition A synthetic tetrapeptide comprising Ac-Cha, Arg, Tic and Met-NH2 residues coupled in sequence.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C32H50N8O5S
Net Charge 0
Average Mass 658.85500
Monoisotopic Mass 658.36249
InChI InChI=1S/C32H50N8O5S/c1-20(41)37-26(17-21-9-4-3-5-10-21)29(43)39-25(13-8-15-36-32(34)35)31(45)40-19-23-12-7-6-11-22(23)18-27(40)30(44)38-24(28(33)42)14-16-46-2/h6-7,11-12,21,24-27H,3-5,8-10,13-19H2,1-2H3,(H2,33,42)(H,37,41)(H,38,44)(H,39,43)(H4,34,35,36)/t24-,25-,26-,27-/m0/s1
InChIKey VDTJFSUTITZPPI-FWEHEUNISA-N
SMILES CSCC[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC1CCCCC1)NC(C)=O)C(N)=O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Ac-Cha-Arg-Tic-Met-NH2 (CHEBI:60965) is a tetrapeptide (CHEBI:48030)
IUPAC Name
(3S)-2-(N-acetyl-3-cyclohexyl-L-alanyl-L-arginyl)-N-[(2S)-1-amino-4-(methylsulfanyl)-1-oxobutan-2-yl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Synonyms Sources
Ac-(Cha)R(Tic)M-NH2 ChEBI
AcChaArgTicMetNH2 ChEBI
Citation Waiting for Citations Type Source
17081730 PubMed citation Europe PMC
Last Modified
14 January 2011