bullatetrocin

Right Click Jmol Molecule For More Options. Jmol is a free download found Here.
IUPAC Name :(2S)-4-[(13R)-13-hydroxy-13-[(2R,5R)-5-[(2R,5R)-5-[(1S,8R,9S)-1,8,9-trihydroxyundecyl]oxolan-2-yl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one
InChI :InChI=1/C37H66O8/c1-3-29(38)30(39)19-15-12-13-17-21-32(41)34-23-25-36(45-34)35-24-22-33(44-35)31(40)20-16-11-9-7-5-4-6-8-10-14-18-28-26-27(2)43-37(28)42/h26-27,29-36,38-41H,3-25H2,1-2H3/t27-,29-,30+,31+,32-,33+,34+,35+,36+/m0/s1
Std.InChI: InChI=1S/C37H66O8/c1-3-29(38)30(39)19-15-12-13-17-21-32(41)34-23-25-36(45-34)35-24-22-33(44-35)31(40)20-16-11-9-7-5-4-6-8-10-14-18-28-26-27(2)43-37(28)42/h26-27,29-36,38-41H,3-25H2,1-2H3/t27-,29-,30+,31+,32-,33+,34+,35+,36+/m0/s1
InChIKey :FXUFAUVCSYAYLC-MKQHPUIBBM
Std.InChIKey: FXUFAUVCSYAYLC-MKQHPUIBSA-N
SMILES :CC[C@@H]([C@@H](CCCCCC[C@@H]([C@H]1CC[C@@H](O1)[C@H]2CC[C@@H](O2)[C@@H](CCCCCCCCCCCCC3=C[C@@H](OC3=O)C)O)O)O)O
Molar Refractivity :177.82 ± 0.3 cm3 (est)
Parachor :1523.7 ± 6.0 cm3 (est)
Index of Refraction :1.515 ± 0.02 (est)
Surface Tension :44.8 ± 3.0 dyne/cm (est)
Density :1.085 ± 0.06 g/cm3 (est)
Polarizability :70.49 ± 0.5 10-24cm3 (est)