Kelatorphan
[CAS# 92175-57-0]

Identification

• Name: Kelatorphan
• Synonyms: (2S)-2-[[(2R)-4-(Hydroxyamino)-1,4-Dioxo-2-(Phenylmethyl)Butyl]Amino]Propanoic Acid; (2S)-2-[[(2R)-2-(Benzyl)-4-(Hydroxyamino)-4-Keto-Butanoyl]Amino]Propionic Acid; (3-(N-Hydroxy)Carboxamido-2-Benzylpropanoyl)Alanine
• Molecular Formula: C₁₄H₁₈N₂O₅
• Molecular Weight: 294.31
• CAS Registry Number: 92175-57-0
• SMILES: [C@H](C(N[C@H](C(=O)O)C)=O)(CC(=O)NO)CC1=CC=CC=C1
• InChI: 1S/C14H18N2O5/c1-9(14(19)20)15-13(18)11(8-12(17)16-21)7-10-5-3-2-4-6-10/h2-6,9,11,21H,7-8H2,1H3,(H,15,18)(H,16,17)(H,19,20)/t9-,11+/m0/s1
• InChIKey: OJCFZTVYDSKXNM-GXSJLCMTSA-N

Properties

• Density: 1.302g/cm³ (Cal.)