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Phe-CO-Arg-Val-Dphe

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CAT#	OPO-024
CAS	83830-01-7
Synonyms/Alias	beta-MAPI, Phe-CO-Arg-Val-D-Phe-H, N-(N-(N2-(((1-Carboxy-2-phenylethyl)amino)carbonyl)-L-arginyl)-L-valyl)-D-phenylalanine, aldehyde deriv.
Chemical Name	(2S)-2-[[(2S)-5-(diaminomethylideneamino)-1-[[(2S)-3-methyl-1-oxo-1-[[(2R)-1-oxo-3-phenylpropan-2-yl]amino]butan-2-yl]amino]-1-oxopentan-2-yl]carbamoylamino]-3-phenylpropanoic acid
M.F/Formula	C30H41N7O6
M.W/Mr.	595.7

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InChI	InChI=1S/C30H41N7O6/c1-19(2)25(27(40)34-22(18-38)16-20-10-5-3-6-11-20)37-26(39)23(14-9-15-33-29(31)32)35-30(43)36-24(28(41)42)17-21-12-7-4-8-13-21/h3-8,10-13,18-19,22-25H,9,14-17H2,1-2H3,(H,34,40)(H,37,39)(H,41,42)(H4,31,32,33)(H2,35,36,43)/t22-,23+,24+,25+/m1/s1
InChI Key	SABSBIPNNYDZRS-ROHNOIKCSA-N
Canonical SMILES	CC(C)C(C(=O)NC(CC1=CC=CC=C1)C=O)NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC2=CC=CC=C2)C(=O)O
Isomeric SMILES	CC(C)[C@@H](C(=O)N[C@H](CC1=CC=CC=C1)C=O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)O