Ceramide (D18:1/18:0)

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Properties Simple | Detailed

Formula C36H71NO3
IUPAC Name n-[(e,1s,2r)-2-hydroxy-1-(hydroxymethyl)heptadec-3-enyl]octadecanamide
Molecular Mass 565.954 g·mol−1
Heat of Formation -1206.6 ± 16.7 kJ·mol−1
Dipole Moment 3.76 ± 1.08 D
Volume 839.57 Å 3
Surface Area 776.93 Å 2
HOMO Energy -9.76 ± 0.55 eV
LUMO Energy 3.56 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3r,4e)-2-acylamino-1,3-octadec-4-enediol
  • (2s,3r,4e)-2-acylaminooctadec-4-ene-1,3-diol
  • cer(d18:1/18:0)
  • ceramide (egg)
  • cmc_12037
  • cmc_12704
  • lmsp02010006
  • n-((2s,3r,e)-1,3-dihydroxyoctadec-4-en-2-yl)stearamide
  • n-(octadecanoyl)-sphing-4-enine
  • n-[(e,1s,2r)-2-hydroxy-1-(hydroxymethyl)heptadec-3-enyl]octadecanamide
  • n-[(e,1s,2r)-2-hydroxy-1-methylol-heptadec-3-enyl]stearamide
  • n-[(e,2s,3r)-1,3-dihydroxyoctadec-4-en-2-yl]octadecanamide
  • octadecanamide, n-[(1s,2r,3e)-2-hydroxy-1-(hydroxymethyl)-3-heptadecenyl]-
CAS Number(s)
  • 104404-17-3
InChIKey VODZWWMEJITOND-NXCSZAMKSA-N
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