Met006292: PC(O-10:1(9E)/0:0)
Metabolite Information
Name
PC(O-10:1(9E)/0:0)
IUPAC Name
[(2R)-3-dec-9-enoxy-2-hydroxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Molecular Formula
C18H38NO6P
Molecular Weight
395.5
Exact Mass
395.2436749
SMILES
C[N+](C)(C)CCOP(=O)([O-])OCC(COCCCCCCCCC=C)O
InChIKey
XNDMKOYJBQLIFZ-GOSISDBHSA-N
InChI
InChI=1S/C18H38NO6P/c1-5-6-7-8-9-10-11-12-14-23-16-18(20)17-25-26(21,22)24-15-13-19(2,3)4/h5,18,20H,1,6-17H2,2-4H3/t18-/m1/s1
Other Databases Link
Structure
2D Structure
3D Structure
Classification
(data sourced from ClassyFire)
Kingdom:
Organic compounds
Superclass:
Lipids and lipid-like molecules
Class:
Glycerophospholipids
Subclass:
Glycerophosphocholines
Crops containing this metabolite
broad_bean
spinach
spinach
Metabolite Spectrum Accession Label