Phoslactomycin B
[CAS# 122856-26-2]

Identification

• Name: Phoslactomycin B
• Synonyms: [(4E,6E)-1-[(E)-1-(2-Aminoethyl)-3-(3-Ethyl-6-Oxo-2,3-Dihydropyran-2-Yl)-1-Hydroxy-Prop-2-Enyl]-7-Cyclohexyl-3-Hydroxy-Hepta-4,6-Dienyl] Dihydrogen Phosphate; [(4E,6E)-1-[(E)-1-(2-Aminoethyl)-3-(3-Ethyl-6-Oxo-2,3-Dihydropyran-2-Yl)-1-Hydroxyprop-2-Enyl]-7-Cyclohexyl-3-Hydroxyhepta-4,6-Dienyl] Dihydrogen Phosphate; [(4E,6E)-1-[(E)-1-(2-Aminoethyl)-3-(3-Ethyl-6-Keto-2,3-Dihydropyran-2-Yl)-1-Hydroxy-Prop-2-Enyl]-7-Cyclohexyl-3-Hydroxy-Hepta-4,6-Dienyl] Dihydrogen Phosphate
• Molecular Formula: C₂₅H₄₀NO₈P
• Molecular Weight: 513.57
• CAS Registry Number: 122856-26-2 (124123-09-7)
• SMILES: C(C(O)(C(O[P](=O)(O)O)CC(O)\C=C\C=C\C1CCCCC1)\C=C\C2OC(=O)C=CC2CC)CN
• InChI: 1S/C25H40NO8P/c1-2-20-12-13-24(28)33-22(20)14-15-25(29,16-17-26)23(34-35(30,31)32)18-21(27)11-7-6-10-19-8-4-3-5-9-19/h6-7,10-15,19-23,27,29H,2-5,8-9,16-18,26H2,1H3,(H2,30,31,32)/b10-6+,11-7+,15-14+
• InChIKey: GAIPQMSJLNWRGC-VYTJGNNZSA-N

Properties

• Density: 1.309g/cm³ (Cal.)
• Boiling point: 753.09°C at 760 mmHg (Cal.)
• Flash point: 409.254°C (Cal.)