84696-21-9 Purity
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Specification
The molecular formula of Gly-His-Lys is C14H24N6O4.
The molecular weight of Gly-His-Lys is 340.38 g/mol.
The IUPAC name of Gly-His-Lys is (2S)-6-amino-2-[[(2S)-2-[(2-aminoacetyl)amino]-3-(1H-imidazol-5-yl)propanoyl]amino]hexanoic acid.
The InChI of Gly-His-Lys is InChI=1S/C14H24N6O4/c15-4-2-1-3-10(14(23)24)20-13(22)11(19-12(21)6-16)5-9-7-17-8-18-9/h7-8,10-11H,1-6,15-16H2,(H,17,18)(H,19,21)(H,20,22)(H,23,24)/t10-,11-/m0/s1.
The InChIKey of Gly-His-Lys is MVORZMQFXBLMHM-QWRGUYRKSA-N.
The canonical SMILES of Gly-His-Lys is C1=C(NC=N1)CC(C(=O)NC(CCCCN)C(=O)O)NC(=O)CN.
The CAS number of Gly-His-Lys is 49557-75-7.
The ChEMBL ID of Gly-His-Lys is CHEMBL1814493.
The hydrogen bond donor count of Gly-His-Lys is 6.
The topological polar surface area of Gly-His-Lys is 176 ?2.