6-Hexadecanoylamino-4-methylumbelliferyl Phosphorylcholine

Analyte Name

6-Hexadecanoylamino-4-methylumbelliferyl Phosphorylcholine

CAS Number

904315-61-3

Molecular Formula

C31 H51 N2 O7 P

Molecular Weight

594.72

Accurate Mass

594.3434

SMILES

CCCCCCCCCCCCCCCC(=O)Nc1cc2C(=CC(=O)Oc2cc1OP(=O)([O-])OCC[N+](C)(C)C)C

InChI

InChI=1S/C31H51N2O7P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-30(34)32-27-23-26-25(2)22-31(35)39-28(26)24-29(27)40-41(36,37)38-21-20-33(3,4)5/h22-24H,6-21H2,1-5H3,(H-,32,34,36,37)

IUPAC

[6-(hexadecanoylamino)-4-methyl-2-oxochromen-7-yl] 2-(trimethylazaniumyl)ethyl phosphate

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity

Product Format

Neat

Purity

>95% (HPLC)