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Leucyl-Phenylalanyl-Isoleucyl-Glutamyl-Tryptophyl-Leucyl-Lysine Trifluoroacetate-[d10]

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General Information
Catalog: BLP-006490
Molecular Formula: C51H64D10F3N9O12
Molecular Weight: 1072.24

Chemical Structure

Synonyms	Leucyl-Phenylalanyl-Isoleucyl-Glutamyl-Tryptophyl-Leucyl-d10-Lysine Trifluoroacetate
IUPAC Name	(2R)-6-amino-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-amino-4-methylpentanoyl]amino]-3-phenylpropanoyl]amino]-3-methylpentanoyl]amino]-4-carboxybutanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-2,3,3,4,5,5,5-heptadeuterio-4-(trideuteriomethyl)pentanoyl]amino]hexanoic acid;2,2,2-trifluoroacetic acid
Canonical SMILES	CCC(C)C(C(=O)NC(CCC(=O)O)C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC(CC(C)C)C(=O)NC(CCCCN)C(=O)O)NC(=O)C(CC3=CC=CC=C3)NC(=O)C(CC(C)C)N.C(=O)(C(F)(F)F)O
InChI	InChI=1S/C49H73N9O10.C2HF3O2/c1-7-30(6)42(58-47(65)39(25-31-15-9-8-10-16-31)55-43(61)34(51)23-28(2)3)48(66)53-36(20-21-41(59)60)44(62)57-40(26-32-27-52-35-18-12-11-17-33(32)35)46(64)56-38(24-29(4)5)45(63)54-37(49(67)68)19-13-14-22-50;3-2(4,5)1(6)7/h8-12,15-18,27-30,34,36-40,42,52H,7,13-14,19-26,50-51H2,1-6H3,(H,53,66)(H,54,63)(H,55,61)(H,56,64)(H,57,62)(H,58,65)(H,59,60)(H,67,68);(H,6,7)/t30-,34-,36-,37+,38?,39-,40-,42-;/m0./s1/i4D3,5D3,24D2,29D,38D;
InChI Key	VXVZGAUCQQRYNR-UDJRLZEMSA-N
Purity	>98%