2-Palmitoyl-sn-glycero-3-phosphocholine

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Catalog Number
ACM66757275
Product Name
2-Palmitoyl-sn-glycero-3-phosphocholine
Structure
Structure
CAS
66757-27-5
Category
Heterocyclic Organic Compound
Synonyms
(7R)-4-Hydroxy-7-(hydroxyMethyl)-N,N,N-trimethyl-9-oxo-3,5,8-trioxa-4-phosphatetracosan-1-aminium 4-oxide
IUPAC Name
(2R)-2-(Hexadecanoyloxy)-3-hydroxypropyl 2-(trimethylazaniumyl)ethyl phosphate
Molecular Weight
495.6
Molecular Formula
C24H50NO7P
Canonical SMILES
CCCCCCCCCCCCCCCC(=O)OC(CO)COP(=O)([O-])OCC[N+](C)(C)C
InChI
InChI=1S/C24H50NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(27)32-23(21-26)22-31-33(28,29)30-20-19-25(2,3)4/h23,26H,5-22H2,1-4H3/t23-/m1/s1
InChI Key
NEGQHKSYEYVFTD-HSZRJFAPSA-N
Complexity
517
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
1
Exact Mass
495.33248993
H-Bond Acceptor
7
H-Bond Donor
1
Heavy Atom Count
33
Hydrogen Bond Acceptor Count
7
Hydrogen Bond Donor Count
1
Isomeric SMILES
CCCCCCCCCCCCCCCC(=O)O[C@H](CO)COP(=O)([O-])OCC[N+](C)(C)C
Monoisotopic Mass
495.33248993
Physical State
Powder
Rotatable Bond Count
24
Storage Conditions
-20 °C
Topological Polar Surface Area
105 Ų
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