In-Silico Structure Database (LMISSD)
Common Name
PC(O-16:0/38:0)
Systematic Name
1-hexadecyl-2-octatriacontanoyl-sn-glycero-3-phosphocholine
LM ID
LMGP01029AG5
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1027.927192
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphocholines [GP01]
1-alkyl,2-acylglycerophosphocholines [GP0102]
String Representations
InChiKey (Click to copy)
UTOXODUQJHKXNT-QRXDBQBNSA-N
InChi (Click to copy)
InChI=1S/C62H126NO7P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-40-41-42-43-45-47-49-51-53-55-62(64)70-61(60-69-71(65,66)68-58-56-63(3,4)5)59-67-57-54-52-50-48-46-44-21-19-17-15-13-11-9-7-2/h61H,6-60H2,1-5H3/t61-/m1/s1
SMILES (Click to copy)
[C@](COP(=O)([O-])OCC[N+](C)(C)C)([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)COCCCCCCCCCCCCCCCC