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18:0 EPC chloride

CAT: 0931-T74318-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T74318-01Size:5 mg
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CAS Number
328268-13-9
Target
Others, Liposome
Related Pathways
Others, Metabolism
Bioactivity
18:0 EPC chloride, a synthetic cationic phospholipid, significantly enhances eugenol's inactivation effect on Escherichia coli [1] when used at critical synergistic concentrations ranging from 2.34 to 2.93 μM.
Smiles
[Cl-].CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(OCC)OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
Molecular Formula
C46H93ClNO8P
Molecular Weight
854.66
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

18:0 EPC (Cl Salt)
CAS Number328268-13-9
PubChem CID131877843
IUPAC Name2-[[(2R)-2,3-di(octadecanoyloxy)propoxy]-ethoxyphosphoryl]oxyethyl-trimethylazanium chloride
Molecular FormulaC46H93ClNO8P
Molecular Weight854.7
Topological Polar Surface Area97.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count9
Rotatable Bond Count46
Heavy Atom Count57
Formal Charge0
Complexity927
SMILES
CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(OCC)OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC.[Cl-]
InChI
InChI=1S/C46H93NO8P.ClH/c1-7-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-45(48)51-42-44(43-54-56(50,52-9-3)53-41-40-47(4,5)6)55-46(49)39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-8-2;/h44H,7-43H2,1-6H3;1H/q+1;/p-1/t44-,56?;/m1./s1
InChIKey
ZVWMOQRUUFNEHD-UFOBXVRVSA-M
Chemical Structure
2D Structure
2D structure of 18:0 EPC (Cl Salt)
CAS: 328268-13-9
CID: 131877843
Formula: C46H93ClNO8P
MW: 854.7
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight854.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count9
Rotatable Bond Count46
Exact Mass853.6327336
Monoisotopic Mass853.6327336
Topological Polar Surface Area97.4 Ų
Heavy Atom Count57
Formal Charge0
Complexity927
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes