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DL-Dipalmitoylphosphatidylcholine

CAT: 0013-GTR19248840-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19248840-01Size:100 mg
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Description
DL-Dipalmitoylphosphatidylcholine (DL-DPPC) is a biochemical reagent.
CAS Number
2644-64-6
Smiles
O=C (CCCCCCCCCCCCCCC) OCC (COP ([O-]) (OCC[N+] (C) (C) C) =O) OC (CCCCCCCCCCCCCCC) =O
Molecular Formula
C40H80NO8P
Molecular Weight
734.0389
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1,2-Dipalmitoylphosphatidylcholine

Synthetic phospholipid used in liposomes and lipid bilayers to study biological membranes. It is also a major constituent of PULMONARY SURFACTANTS.

CAS Number2644-64-6
PubChem CID6138
IUPAC Name2,3-di(hexadecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
Molecular FormulaC40H80NO8P
Molecular Weight734.0
XLogP13.5
Topological Polar Surface Area111
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count40
Heavy Atom Count50
Formal Charge0
Complexity826
SMILES
CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
InChI
InChI=1S/C40H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3
InChIKey
KILNVBDSWZSGLL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,2-Dipalmitoylphosphatidylcholine
CAS: 2644-64-6
CID: 6138
Formula: C40H80NO8P
MW: 734.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight734.0
XLogP313.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count40
Exact Mass733.56215551
Monoisotopic Mass733.56215551
Topological Polar Surface Area111 Ų
Heavy Atom Count50
Formal Charge0
Complexity826
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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