2-[[(E)-7,13-Dihydroxyoctadec-2-Enoyl]Amino]Ethanesulfonic Acid
[CAS# 126584-06-3]

Identification

• Name: 2-[[(E)-7,13-Dihydroxyoctadec-2-Enoyl]Amino]Ethanesulfonic Acid
• Synonyms: 2-[[(E)-7,13-Dihydroxy-1-Oxooctadec-2-Enyl]Amino]Ethanesulfonic Acid; 2-(7,13-Dihydroxy-2-Octadecenoylamino)Ethanesulfonic Acid; Ethanesulfonic Acid, 2-((7,13-Dihydroxy-1-Oxo-2-Octadecenyl)Amino)-
• Molecular Formula: C₂₀H₃₉NO₆S
• Molecular Weight: 421.59
• CAS Registry Number: 126584-06-3
• SMILES: C([S](=O)(O)=O)CNC(\C=C\CCCC(CCCCCC(CCCCC)O)O)=O
• InChI: 1S/C20H39NO6S/c1-2-3-6-11-18(22)12-7-4-8-13-19(23)14-9-5-10-15-20(24)21-16-17-28(25,26)27/h10,15,18-19,22-23H,2-9,11-14,16-17H2,1H3,(H,21,24)(H,25,26,27)/b15-10+
• InChIKey: BUUITCQYMHVSNP-XNTDXEJSSA-N

Properties

• Density: 1.132g/cm³ (Cal.)