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

Catalog	DGS20559186
CAS	20559-18-6
Structure
Synonyms	1-Dodecanoyl-sn-glycero-3-phosphocholine; PC(12:0/0:0)
IUPAC Name	[(2R)-3-dodecanoyloxy-2-hydroxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Molecular Weight	439.52
Molecular Formula	C20H42NO7P
InChI	InChI=1S/C20H42NO7P/c1-5-6-7-8-9-10-11-12-13-14-20(23)26-17-19(22)18-28-29(24,25)27-16-15-21(2,3)4/h19,22H,5-18H2,1-4H3/t19-/m1/s1
InChI Key	BWKILASWCLJPBO-LJQANCHMSA-N
Purity	>99%
Appearance	Powder
Complexity	460
Exact Mass	439.26988968
Formal Charge	0
Heavy Atom Count	29
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
Hygroscopic	Yes
Isomeric SMILES	CCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)O
Light Sensitive	No
Monoisotopic Mass	439.26988968
Rotatable Bond Count	20
Stability	1 Year
Storage Conditions	-20 °C
Topological Polar Surface Area	105 Ų
XLogP3-AA	3.4