IUPAC Name :4-[(13S)-2,13-dihydroxy-13-[(2S,5S)-5-[(1S)-1-hydroxytridecyl]oxolan-2-yl]-7-oxotridecyl]-2-methyl-2H-furan-5-one
InChI :InChI=1/C35H62O7/c1-3-4-5-6-7-8-9-10-11-14-21-31(38)33-23-24-34(42-33)32(39)22-15-12-13-18-29(36)19-16-17-20-30(37)26-28-25-27(2)41-35(28)40/h25,27,30-34,37-39H,3-24,26H2,1-2H3/t27?,30?,31-,32-,33-,34-/m0/s1
Std.InChI: InChI=1S/C35H62O7/c1-3-4-5-6-7-8-9-10-11-14-21-31(38)33-23-24-34(42-33)32(39)22-15-12-13-18-29(36)19-16-17-20-30(37)26-28-25-27(2)41-35(28)40/h25,27,30-34,37-39H,3-24,26H2,1-2H3/t27?,30?,31-,32-,33-,34-/m0/s1
InChIKey :QCICHLFBIUXRKT-YJWYFJGCBU
Std.InChIKey: QCICHLFBIUXRKT-YJWYFJGCSA-N
SMILES :CCCCCCCCCCCC[C@@H]([C@@H]1CC[C@H](O1)[C@H](CCCCCC(=O)CCCCC(CC2=CC(OC2=O)C)O)O)O
Molar Refractivity :167.53 ± 0.3 cm3 (est)
Parachor :1447.0 ± 6.0 cm3 (est)
Index of Refraction :1.502 ± 0.02
(est)
Surface Tension :42.2 ± 3.0 dyne/cm (est)
Density :1.047 ± 0.06 g/cm3 (est)
Polarizability :66.41 ± 0.5 10-24cm3 (est)