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

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CHEBI:60965 - Ac-Cha-Arg-Tic-Met-NH₂

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ChEBI ID	CHEBI:60965
ChEBI Name	Ac-Cha-Arg-Tic-Met-NH₂
Stars
ASCII Name	Ac-Cha-Arg-Tic-Met-NH2
Definition	A synthetic tetrapeptide comprising Ac-Cha, Arg, Tic and Met-NH₂ residues coupled in sequence.
Last Modified	14 January 2011
Submitter	Steve
Downloads	Molfile

Formula	C32H50N8O5S
Net Charge	0
Average Mass	658.870
Monoisotopic Mass	658.36249
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
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

Roles Classification

Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid).

ChEBI Ontology

Outgoing Relation(s)
	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	Source
Ac-(Cha)R(Tic)M-NH₂	ChEBI
AcChaArgTicMetNH2	ChEBI

Citations