quassimarin

Right Click Jmol Molecule For More Options. Jmol is a free download found Here.
InChI :InChI=1/C27H36O11/c1-7-24(4,38-12(3)28)23(34)37-17-19-26(6)21(32)16(30)18-25(5)13(11(2)8-14(29)20(25)31)9-15(36-22(17)33)27(18,19)10-35-26/h8,13,15-21,30-32H,7,9-10H2,1-6H3/t13-,15+,16+,17+,18+,19-,20+,21-,24+,25-,26-,27+/m0/s1
Std.InChI: InChI=1S/C27H36O11/c1-7-24(4,38-12(3)28)23(34)37-17-19-26(6)21(32)16(30)18-25(5)13(11(2)8-14(29)20(25)31)9-15(36-22(17)33)27(18,19)10-35-26/h8,13,15-21,30-32H,7,9-10H2,1-6H3/t13-,15+,16+,17+,18+,19-,20+,21-,24+,25-,26-,27+/m0/s1
InChIKey :FXMIXHYJCNZLFE-ACBKHETBBD
Std.InChIKey: FXMIXHYJCNZLFE-ACBKHETBSA-N
SMILES :CC[C@](C)(C(=O)O[C@@H]1[C@H]2[C@]3([C@H]([C@@H]([C@H]4[C@@]2(CO3)[C@@H](C[C@@H]5[C@@]4([C@@H](C(=O)C=C5C)O)C)OC1=O)O)O)C)OC(=O)C
Molar Refractivity :128.42 ± 0.4 cm3 (est)
Parachor :1070.0 ± 6.0 cm3 (est)
Index of Refraction :1.591 ± 0.03 (est)
Surface Tension :63.0 ± 5.0 dyne/cm (est)
Density :1.41 ± 0.1 g/cm3 (est)
Polarizability :50.91 ± 0.5 10-24cm3 (est)