IUPAC Name :N-[(E,2S,3R)-1,3-dihydroxyoctadec-4-en-2-yl]octadecanamide (ceramide 6 II)
InChI :InChI=1/C36H71NO3/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-36(40)37-34(33-38)35(39)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h29,31,34-35,38-39H,3-28,30,32-33H2,1-2H3,(H,37,40)/b31-29+/t34-,35+/m0/s1
Std.InChI: InChI=1S/C36H71NO3/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-36(40)37-34(33-38)35(39)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h29,31,34-35,38-39H,3-28,30,32-33H2,1-2H3,(H,37,40)/b31-29+/t34-,35+/m0/s1
InChIKey :VODZWWMEJITOND-NXCSZAMKBA
Std.InChIKey: VODZWWMEJITOND-NXCSZAMKSA-N
SMILES :O=C(N[C@H]([C@H](O)/C=C/CCCCCCCCCCCCC)CO)CCCCCCCCCCCCCCCCC
Molar Refractivity :173.71 ± 0.5 cm3 (est)
Parachor :1466.0 ± 8.0 cm3 (est)
Index of Refraction :1.485 ± 0.05
(est)
Surface Tension :34.2 ± 7.0 dyne/cm (est)
Density :0.93 ± 0.1 g/cm3 (est)
Polarizability :68.86 ± 0.5 10-24cm3 (est)