Ac-Cha-Arg-MePhg-Met-Ala-Ser-tLeu-NH2 (CHEBI:62368)

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CHEBI:62368 - Ac-Cha-Arg-MePhg-Met-Ala-Ser-tLeu-NH₂

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ChEBI ID	CHEBI:62368
ChEBI Name	Ac-Cha-Arg-MePhg-Met-Ala-Ser-tLeu-NH₂
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ASCII Name	Ac-Cha-Arg-MePhg-Met-Ala-Ser-tLeu-NH2
Definition	A synthetic seven-membered oligopeptide comprising Ac-Cha, Arg, MePhg, Met, Ala, Ser and tLeu-NH₂ residues coupled in sequence.
Last Modified	17 June 2011
Submitter	Steve
Downloads	Molfile

Formula	C43H71N11O9S
Net Charge	0
Average Mass	918.176
Monoisotopic Mass	917.51569
SMILES	CSCC[C@H](NC(=O)[C@H](c1ccccc1)N(C)C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC1CCCCC1)NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(N)=O)C(C)(C)C
InChI	InChI=1S/C43H71N11O9S/c1-25(36(58)52-32(24-55)39(61)53-34(35(44)57)43(3,4)5)48-37(59)29(20-22-64-7)50-40(62)33(28-17-12-9-13-18-28)54(6)41(63)30(19-14-21-47-42(45)46)51-38(60)31(49-26(2)56)23-27-15-10-8-11-16-27/h9,12-13,17-18,25,27,29-34,55H,8,10-11,14-16,19-24H2,1-7H3,(H2,44,57)(H,48,59)(H,49,56)(H,50,62)(H,51,60)(H,52,58)(H,53,61)(H4,45,46,47)/t25-,29-,30-,31-,32-,33-,34+/m0/s1
InChIKey	TUCXIPWOBWBJME-LRMIZQCZSA-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-MePhg-Met-Ala-Ser-tLeu-NH₂ (CHEBI:62368) is a oligopeptide (CHEBI:25676)

IUPAC Name
N-{(2S)-2-[(N-acetyl-3-cyclohexyl-L-alanyl-L-arginyl)(methyl)amino]-2-phenylacetyl}-L-methionyl-L-alanyl-L-seryl-3-methyl-L-valinamide

Synonyms	Source
Ac(Cha)Arg(MePhg)MetAlaSer(tLeu)-NH₂	ChEBI
Ac-(Cha)R(MePhg)MAS(tLeu)-NH₂	ChEBI

Registry Numbers	Sources
Reaxys:8672300	Reaxys