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16:0 Phosphatidylpropanol

CAT: 0804-HY-170463Size: 1 EachDry Ice: NoHazardous: No
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Description
16:0 Phosphatidylpropanol (1,2-Dipalmitoyl-sn-glycero-3-phosphopropanol) sodium is a phosphatidyl alcohol with propanol head groups[1].
CAS Number
92609-91-1
Product Name Alternative
1,2-Dipalmitoyl-sn-glycero-3-phosphopropanol (sodium)
UNSPSC
12352200
Target
Biochemical Assay Reagents
Related Pathways
Others
Field of Research
Others
Smiles
CCCCCCCCCCCCCCCC(O[C@@H](COP(OCCC)(O[Na])=O)COC(CCCCCCCCCCCCCCC)=O)=O
Molecular Formula
C38H74NaO8P
Molecular Weight
712.95
References & Citations
[1]Jaikishan S, et al. Phosphatidyl alcohols: effect of head group size on domain forming properties and interactions with sterols. Biochim Biophys Acta. 2010 Aug;1798 (8) :1615-22.
Shipping Conditions
Room temperature
Scientific Category
Biochemical Assay Reagents
Clinical Information
No Development Reported

Chemical Information

Sodium (2R)-2,3-bis(hexadecanoyloxy)propyl propyl phosphate
CAS Number92609-91-1
PubChem CID46891691
IUPAC Namesodium [(2R)-2,3-di(hexadecanoyloxy)propyl] propyl phosphate
Molecular FormulaC38H74NaO8P
Molecular Weight713.0
Topological Polar Surface Area111
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count39
Heavy Atom Count48
Formal Charge0
Complexity754
SMILES
CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCC)OC(=O)CCCCCCCCCCCCCCC.[Na+]
InChI
InChI=1S/C38H75O8P.Na/c1-4-7-9-11-13-15-17-19-21-23-25-27-29-31-37(39)43-34-36(35-45-47(41,42)44-33-6-3)46-38(40)32-30-28-26-24-22-20-18-16-14-12-10-8-5-2;/h36H,4-35H2,1-3H3,(H,41,42);/q;+1/p-1/t36-;/m1./s1
InChIKey
SKVWIBXHTOHOAB-SKRAEFHRSA-M
Chemical Structure
2D Structure
2D structure of Sodium (2R)-2,3-bis(hexadecanoyloxy)propyl propyl phosphate
CAS: 92609-91-1
CID: 46891691
Formula: C38H74NaO8P
MW: 713.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight713.0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count39
Exact Mass712.50190059
Monoisotopic Mass712.50190059
Topological Polar Surface Area111 Ų
Heavy Atom Count48
Formal Charge0
Complexity754
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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