IUPAC Name :(2E)-2-[(2R,3S,4S)-4-hydroxy-2-(3-hydroxypropyl)-3-[(3E,6E)-5-hydroxy-4,8,12-trimethyltrideca-3,6,11-trienyl]-3,4-dimethylcyclohexylidene]propanal
InChI :InChI=1/C30H50O4/c1-22(2)11-8-12-23(3)15-16-28(33)24(4)13-9-18-29(6)27(14-10-20-31)26(25(5)21-32)17-19-30(29,7)34/h11,13,15-16,21,23,27-28,31,33-34H,8-10,12,14,17-20H2,1-7H3/b16-15+,24-13+,26-25+/t23?,27-,28?,29+,30+/m1/s1
Std.InChI: InChI=1S/C30H50O4/c1-22(2)11-8-12-23(3)15-16-28(33)24(4)13-9-18-29(6)27(14-10-20-31)26(25(5)21-32)17-19-30(29,7)34/h11,13,15-16,21,23,27-28,31,33-34H,8-10,12,14,17-20H2,1-7H3/b16-15+,24-13+,26-25+/t23?,27-,28?,29+,30+/m1/s1
InChIKey :BIXXDPOEXJMBRN-YIEYGMELBH
Std.InChIKey: BIXXDPOEXJMBRN-YIEYGMELSA-N
SMILES :CC(CCC=C(C)C)/C=C/C(/C(=C/CC[C@]1([C@@H](/C(=C(\C)/C=O)/CC[C@]1(C)O)CCCO)C)/C)O
Molar Refractivity :143.14 ± 0.3 cm3 (est)
Parachor :1184.2 ± 6.0 cm3 (est)
Index of Refraction :1.510 ± 0.02
(est)
Surface Tension :37.5 ± 3.0 dyne/cm (est)
Density :0.992 ± 0.06 g/cm3 (est)
Polarizability :56.74 ± 0.5 10-24cm3 (est)