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

Catalog	DGS325171593
CAS	325171-59-3
Synonyms	1-Tetracosanoyl-sn-glycero-3-phosphocholine; PC(24:0/0:0)
IUPAC Name	[(2R)-2-hydroxy-3-tetracosanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Molecular Weight	607.84
Molecular Formula	C32H66NO7P
InChI	InChI=1S/C32H66NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-32(35)38-29-31(34)30-40-41(36,37)39-28-27-33(2,3)4/h31,34H,5-30H2,1-4H3/t31-/m1/s1
InChI Key	SKJMUADLQLZAGH-WJOKGBTCSA-N
Purity	>99%
Appearance	Powder
Complexity	634
Exact Mass	607.45769044
Formal Charge	0
Heavy Atom Count	41
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
Hygroscopic	Yes
Isomeric SMILES	CCCCCCCCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)O
Light Sensitive	No
Monoisotopic Mass	607.45769044
Rotatable Bond Count	32
Stability	1 Year
Storage Conditions	-20 °C
Topological Polar Surface Area	105 Ų
XLogP3-AA	9.9