N(2),N(5)-Di-(1-oxo-3-hydroxy-3,4-dicarboxylbutyl)ornithine
[CAS# 127902-98-1]

Identification

• Name: N(2),N(5)-Di-(1-oxo-3-hydroxy-3,4-dicarboxylbutyl)ornithine
• Synonyms: 2-[2-[[1-Carboxy-4-[(3-Carboxy-3,5-Dihydroxy-5-Oxo-Pentanoyl)Amino]Butyl]Amino]-2-Oxo-Ethyl]-2-Hydroxy-Butanedioic Acid; 2-[2-[[1-Carboxy-4-[(3-Carboxy-3,5-Dihydroxy-1,5-Dioxopentyl)Amino]Butyl]Amino]-2-Oxoethyl]-2-Hydroxybutanedioic Acid; 2-[2-[[1-Carboxy-4-[(3-Carboxy-3,5-Dihydroxy-5-Keto-Pentanoyl)Amino]Butyl]Amino]-2-Keto-Ethyl]-2-Hydroxy-Succinic Acid
• Molecular Formula: C₁₇H₂₄N₂O₁₄
• Molecular Weight: 480.38
• CAS Registry Number: 127902-98-1
• SMILES: C(C(C(=O)O)NC(CC(C(=O)O)(CC(=O)O)O)=O)CCNC(CC(C(=O)O)(CC(=O)O)O)=O
• InChI: 1S/C17H24N2O14/c20-9(4-16(32,14(28)29)6-11(22)23)18-3-1-2-8(13(26)27)19-10(21)5-17(33,15(30)31)7-12(24)25/h8,32-33H,1-7H2,(H,18,20)(H,19,21)(H,22,23)(H,24,25)(H,26,27)(H,28,29)(H,30,31)
• InChIKey: VJSIXUQLTJCRCS-UHFFFAOYSA-N

Properties

• Density: 1.659g/cm³ (Cal.)
• Boiling point: 949.449°C at 760 mmHg (Cal.)
• Flash point: 528.008°C (Cal.)