6-(3-Amino-4-Hydroxy-4-Oxobutyl)-7-(4-Amino-5-Hydroxy-5-Oxopentyl)-3,4,4a,5-Tetrahydro-2H-Cyclopenta[E]Pyridine-2-Carboxylic Acid
[CAS# 145853-95-8]

Identification

• Name: 6-(3-Amino-4-Hydroxy-4-Oxobutyl)-7-(4-Amino-5-Hydroxy-5-Oxopentyl)-3,4,4a,5-Tetrahydro-2H-Cyclopenta[E]Pyridine-2-Carboxylic Acid
• Synonyms: 6-(3-Amino-4-Hydroxy-4-Oxo-Butyl)-7-(4-Amino-5-Hydroxy-5-Oxo-Pentyl)-3,4,4A,5-Tetrahydro-2H-Cyclopenta[E]Pyridine-2-Carboxylic Acid; 6-(3-Amino-4-Hydroxy-4-Keto-Butyl)-7-(4-Amino-5-Hydroxy-5-Keto-Pentyl)-3,4,4A,5-Tetrahydro-2H-1-Pyrindine-2-Carboxylic Acid; 6-(3-Amino-3-Carboxypropyl)-7-(4-Amino-4-Carboxybutyl)-6-Cyclopenteno(E)-2,3,4,4A-Tetrahydropipecolinic Acid
• Molecular Formula: C₁₈H₂₇N₃O₆
• Molecular Weight: 381.43
• CAS Registry Number: 145853-95-8
• SMILES: C(C1=C(CC2C1=NC(CC2)C(=O)O)CCC(N)C(=O)O)CCC(N)C(=O)O
• InChI: 1S/C18H27N3O6/c19-12(16(22)23)3-1-2-11-9(4-6-13(20)17(24)25)8-10-5-7-14(18(26)27)21-15(10)11/h10,12-14H,1-8,19-20H2,(H,22,23)(H,24,25)(H,26,27)
• InChIKey: FJTYDTXMSNPZKG-UHFFFAOYSA-N

Properties

• Density: 1.543g/cm³ (Cal.)
• Boiling point: 672.915°C at 760 mmHg (Cal.)
• Flash point: 360.766°C (Cal.)