2-Amino-6-[7-Amino-3-(3-Amino-4-Hydroxy-4-Oxobutyl)-2-(4-Amino-5-Hydroxy-5-Oxopentyl)-4-Oxo-6,7-Dihydro-5H-Cyclopenta[E]Pyridin-1-Yl]Hexanoic Acid
[CAS# 147044-50-6]

Identification

• Name: 2-Amino-6-[7-Amino-3-(3-Amino-4-Hydroxy-4-Oxobutyl)-2-(4-Amino-5-Hydroxy-5-Oxopentyl)-4-Oxo-6,7-Dihydro-5H-Cyclopenta[E]Pyridin-1-Yl]Hexanoic Acid
• Synonyms: 2-Amino-6-[7-Amino-3-(3-Amino-4-Hydroxy-4-Oxo-Butyl)-2-(4-Amino-5-Hydroxy-5-Oxo-Pentyl)-4-Oxo-6,7-Dihydro-5H-Cyclopenta[E]Pyridin-1-Yl]Hexanoic Acid; 2-Amino-6-[7-Amino-3-(3-Amino-4-Hydroxy-4-Keto-Butyl)-2-(4-Amino-5-Hydroxy-5-Keto-Pentyl)-4-Keto-6,7-Dihydro-5H-1-Pyrindin-1-Yl]Hexanoic Acid; Isooxodesmosine
• Molecular Formula: C₂₃H₃₇N₅O₇
• Molecular Weight: 495.57
• CAS Registry Number: 147044-50-6
• SMILES: C(N1C2=C(C(=O)C(=C1CCCC(N)C(=O)O)CCC(N)C(=O)O)CCC2N)CCCC(N)C(=O)O
• InChI: 1S/C23H37N5O7/c24-14-9-8-13-19(14)28(11-2-1-4-15(25)21(30)31)18(6-3-5-16(26)22(32)33)12(20(13)29)7-10-17(27)23(34)35/h14-17H,1-11,24-27H2,(H,30,31)(H,32,33)(H,34,35)
• InChIKey: DYRNNGQPCZUVRQ-UHFFFAOYSA-N

Properties

• Density: 1.389g/cm³ (Cal.)
• Boiling point: 791.368°C at 760 mmHg (Cal.)
• Flash point: 432.404°C (Cal.)