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N-Benzoyl-L-tyrosyl-L-alanine-1-[13C]

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General Information
Catalog: BLP-014995
CAS: 851429-73-7
Molecular Formula: C1813CH20N2O5
Molecular Weight: 357.37

Chemical Structure

IUPAC Name	(2S)-2-[[(2S)-2-benzamido-3-(4-hydroxyphenyl)propanoyl]amino](113C)propanoic acid
Isomeric SMILES	C[C@@H]([13C](=O)O)NC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)C2=CC=CC=C2
Canonical SMILES	CC(C(=O)O)NC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C2=CC=CC=C2
InChI	InChI=1S/C19H20N2O5/c1-12(19(25)26)20-18(24)16(11-13-7-9-15(22)10-8-13)21-17(23)14-5-3-2-4-6-14/h2-10,12,16,22H,11H2,1H3,(H,20,24)(H,21,23)(H,25,26)/t12-,16-/m0/s1/i19+1
InChI Key	PSRCBRUPIDLBSA-WOFBRIANSA-N