1-Hydroxy-2-oleoyl-sn-glycero-3-phosphocholine

Catalog	DGS22248653
CAS	22248-65-3
Structure
Synonyms	2-Oleoyl-sn-glycero-3-phosphocholine
IUPAC Name	[(2R)-3-hydroxy-2-[(Z)-octadec-9-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Molecular Weight	521.68
Molecular Formula	C26H52NO7P
InChI	InChI=1S/C26H52NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)34-25(23-28)24-33-35(30,31)32-22-21-27(2,3)4/h12-13,25,28H,5-11,14-24H2,1-4H3/b13-12-/t25-/m1/s1
InChI Key	SULIDBRAXVDKBU-PTGWMXDISA-N
Purity	>99%
Complexity	585
Exact Mass	521.34814000
Formal Charge	0
Heavy Atom Count	35
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
Hygroscopic	No
Isomeric SMILES	CCCCCCCC/C=C\CCCCCCCC(=O)O[C@H](CO)COP(=O)([O-])OCC[N+](C)(C)C
Light Sensitive	No
Monoisotopic Mass	521.34814000
Rotatable Bond Count	25
Stability	1 Year
Storage Conditions	-20 °C
Topological Polar Surface Area	105 Ų
XLogP3-AA	5.7