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DDPC

CAT: 0013-GTR19260279Size: 1 gDry Ice: NoHazardous: No
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CAT#:0013-GTR19260279Size:1 g
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Description
DDPC
CAS Number
108861-07-0
Purity
>98%
Smiles
CCCCCCCCCCCCCC (NCC (COP (OCC[N+] (C) (C) C) (=O) [O-]) NC (CCCCCCCCCCCCC) =O) =O
Molecular Formula
C36H74N3O6P
Molecular Weight
675.96306
Notes
For research use only.

Chemical Information

1,2-Dimyristoylamido-1,2-deoxyphosphatidylcholine

artificial boundary lipid; structure given in first source

CAS Number108861-07-0
PubChem CID130969
IUPAC Name2,3-bis(tetradecanoylamino)propyl 2-(trimethylazaniumyl)ethyl phosphate
Molecular FormulaC36H74N3O6P
Molecular Weight676.0
XLogP10.1
Topological Polar Surface Area117
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count34
Heavy Atom Count46
Formal Charge0
Complexity769
SMILES
CCCCCCCCCCCCCC(=O)NCC(COP(=O)([O-])OCC[N+](C)(C)C)NC(=O)CCCCCCCCCCCCC
InChI
InChI=1S/C36H74N3O6P/c1-6-8-10-12-14-16-18-20-22-24-26-28-35(40)37-32-34(33-45-46(42,43)44-31-30-39(3,4)5)38-36(41)29-27-25-23-21-19-17-15-13-11-9-7-2/h34H,6-33H2,1-5H3,(H2-,37,38,40,41,42,43)
InChIKey
BLCRPWCTEAFGSY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,2-Dimyristoylamido-1,2-deoxyphosphatidylcholine
CAS: 108861-07-0
CID: 130969
Formula: C36H74N3O6P
MW: 676.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight676.0
XLogP310.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count34
Exact Mass675.53152409
Monoisotopic Mass675.53152409
Topological Polar Surface Area117 Ų
Heavy Atom Count46
Formal Charge0
Complexity769
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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