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Phosphatidylethanol

CAT: 0013-GTR19154378-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19154378-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Phosphatidylethanol
CAS Number
322647-55-2
Purity
>98%
Bioactivity
PLD assay standard
Form
Oil/low melting point solid
Solubility
Soluble in Chloroform (up to 10 mg/ml) .
Molecular Formula
C39H74O8P
Molecular Weight
703.0
Storage Conditions
-20°C
Notes
For research use only.
Other Product Names
1-Palmitoyl-2-Oleoyl-sn-glycerol-3-phosphoethanol

Chemical Information

Phosphatidylethanol
CAS Number322647-55-2
PubChem CID57369377
IUPAC Name[(2R)-1-[ethoxy(hydroxy)phosphoryl]oxy-3-hexadecanoyloxypropan-2-yl] octadec-9-enoate
Molecular FormulaC39H75O8P
Molecular Weight703.0
XLogP14
Topological Polar Surface Area108
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count39
Heavy Atom Count48
Formal Charge0
Complexity803
SMILES
CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCC)OC(=O)CCCCCCCC=CCCCCCCCC
InChI
InChI=1S/C39H75O8P/c1-4-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-39(41)47-37(36-46-48(42,43)45-6-3)35-44-38(40)33-31-29-27-25-23-21-18-16-14-12-10-8-5-2/h19-20,37H,4-18,21-36H2,1-3H3,(H,42,43)/t37-/m1/s1
InChIKey
JCABVIFDXFFRMT-DIPNUNPCSA-N
Chemical Structure
2D Structure
2D structure of Phosphatidylethanol
CAS: 322647-55-2
CID: 57369377
Formula: C39H75O8P
MW: 703.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight703.0
XLogP314
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count39
Exact Mass702.51995634
Monoisotopic Mass702.51995634
Topological Polar Surface Area108 Ų
Heavy Atom Count48
Formal Charge0
Complexity803
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count1
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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