Phoslactomycin E
[CAS# 122856-29-5]

Identification

• Name: Phoslactomycin E
• Synonyms: [3-[(1E,3E,9E)-8-(2-Aminoethyl)-10-(3-Ethyl-6-Oxo-2,3-Dihydropyran-2-Yl)-5,8-Dihydroxy-7-Phosphonooxy-Deca-1,3,9-Trienyl]Cyclohexyl] Cyclohexanecarboxylate; Cyclohexanecarboxylic Acid [3-[(1E,3E,9E)-8-(2-Aminoethyl)-10-(3-Ethyl-6-Oxo-2,3-Dihydropyran-2-Yl)-5,8-Dihydroxy-7-Phosphonooxydeca-1,3,9-Trienyl]Cyclohexyl] Ester; Cyclohexanecarboxylic Acid [3-[(1E,3E,9E)-8-(2-Aminoethyl)-10-(3-Ethyl-6-Keto-2,3-Dihydropyran-2-Yl)-5,8-Dihydroxy-7-Phosphonooxy-Deca-1,3,9-Trienyl]Cyclohexyl] Ester
• Molecular Formula: C₃₂H₅₀NO₁₀P
• Molecular Weight: 639.72
• CAS Registry Number: 122856-29-5
• SMILES: C(C(/C=C/C=C/C2CC(OC(C1CCCCC1)=O)CCC2)O)C(C(\C=C\C3C(C=CC(O3)=O)CC)(O)CCN)O[P](=O)(O)O
• InChI: 1S/C32H50NO10P/c1-2-24-15-16-30(35)42-28(24)17-18-32(37,19-20-33)29(43-44(38,39)40)22-26(34)13-7-6-9-23-10-8-14-27(21-23)41-31(36)25-11-4-3-5-12-25/h6-7,9,13,15-18,23-29,34,37H,2-5,8,10-12,14,19-22,33H2,1H3,(H2,38,39,40)/b9-6+,13-7+,18-17+
• InChIKey: VPPYLHODJVARBC-XUQJEITOSA-N

Properties

• Density: 1.274g/cm³ (Cal.)
• Boiling point: 830.431°C at 760 mmHg (Cal.)
• Flash point: 456.028°C (Cal.)