Sphingomyelins

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 635
Total Number of Articles : 1243
PubChem 5353953
Molecular Formula

C41H83N2O6P

SMILES

CCCCCCCCCCCCCCCCCC(=O)NC(COP(=O)([O-])OCC[N+](C)(C)C)C(/C=C/CCCCCCCCCCCCC)O

InChI

InChI=1S/C41H83N2O6P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-41(45)42-39(38-49-50(46,47)48-37-36-43(3,4)5)40(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h32,34,39-40,44H,6-31,33,35-38H2,1-5H3,(H-,42,45,46,47)/b34-32+

synonyms
  • NAcylDsphingosine1phosphocholine
  • CHEBI:64583
  • DTXSID001021895
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Properties
Property Value
MW 731.1 g/mol
HBD 2
HBA 6
Rotatable Bond Count 38
Exact Mass 730.59887537 g/mol
Monoisotopic Mass 730.59887537 g/mol
Heavy Atom Count 50
Isotope Atom Count 0
Atom Stereo Count 2
Covalent Unit Count 1
Complexity 826
xlogp 13.4
Topological Polar Surface Area 108