IUPAC Name :[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1S,2S,4aR,5R,8aR)-1,4a-dimethyl-6-methylidene-5-[(E)-3-methyl-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypent-3-enyl]-1,2,3,4,5,7,8,8a-octahydronaphthalene-2-carboxylate
InChI :InChI=1/C32H52O13/c1-15(10-12-42-30-27(39)25(37)23(35)21(13-33)43-30)5-7-19-16(2)6-8-20-17(3)18(9-11-32(19,20)4)29(41)45-31-28(40)26(38)24(36)22(14-34)44-31/h10,17-28,30-31,33-40H,2,5-9,11-14H2,1,3-4H3/b15-10+/t17-,18+,19-,20-,21-,22-,23-,24-,25+,26+,27-,28-,30-,31+,32+/m1/s1
Std.InChI: InChI=1S/C32H52O13/c1-15(10-12-42-30-27(39)25(37)23(35)21(13-33)43-30)5-7-19-16(2)6-8-20-17(3)18(9-11-32(19,20)4)29(41)45-31-28(40)26(38)24(36)22(14-34)44-31/h10,17-28,30-31,33-40H,2,5-9,11-14H2,1,3-4H3/b15-10+/t17-,18+,19-,20-,21-,22-,23-,24-,25+,26+,27-,28-,30-,31+,32+/m1/s1
InChIKey :LDDXCZQNFBVZEB-RFFKRZOKBI
Std.InChIKey: LDDXCZQNFBVZEB-RFFKRZOKSA-N
SMILES :C[C@@H]1[C@H](CC[C@@]2([C@@H]1CCC(=C)[C@H]2CC/C(=C/CO[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)/C)C)C(=O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O
Molar Refractivity :160.33 ± 0.4 cm3 (est)
Parachor :1353.7 ± 6.0 cm3 (est)
Index of Refraction :1.594 ± 0.03
(est)
Surface Tension :67.6 ± 5.0 dyne/cm (est)
Density :1.36 ± 0.1 g/cm3 (est)
Polarizability :63.56 ± 0.5 10-24cm3 (est)