1-Palmitoyl-2-hydroxy-sn-glycero-3-phosphocholine

Catalog	DGS17364168
CAS	17364-16-8
Structure
Synonyms	1-Hexadecanoyl-sn-glycero-3-phosphocholine; PC(16:0/0:0)
IUPAC Name	[(2R)-3-hexadecanoyloxy-2-hydroxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Molecular Weight	495.63
Molecular Formula	C24H50NO7P
InChI	InChI=1S/C24H50NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(27)30-21-23(26)22-32-33(28,29)31-20-19-25(2,3)4/h23,26H,5-22H2,1-4H3/t23-/m1/s1
InChI Key	ASWBNKHCZGQVJV-HSZRJFAPSA-N
Melting Point	253 °C
Purity	>99%
Appearance	Powder
Complexity	517
Exact Mass	495.33248993
Formal Charge	0
Heavy Atom Count	33
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
Hygroscopic	Yes
Isomeric SMILES	CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)O
Light Sensitive	No
Monoisotopic Mass	495.33248993
Rotatable Bond Count	24
Stability	1 Year
Storage Conditions	-20 °C
Topological Polar Surface Area	105 Ų
XLogP3-AA	5.6