bullatalicin

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IUPAC Name :(2S)-4-[(2R)-9-[(2R,5S)-5-[(1S,4R)-1,4-dihydroxy-4-[(2R,5R)-5-[(1S)-1-hydroxyundecyl]oxolan-2-yl]butyl]oxolan-2-yl]-2-hydroxynonyl]-2-methyl-2H-furan-5-one
InChI :InChI=1/C37H66O8/c1-3-4-5-6-7-8-12-15-18-31(39)35-23-24-36(45-35)33(41)21-20-32(40)34-22-19-30(44-34)17-14-11-9-10-13-16-29(38)26-28-25-27(2)43-37(28)42/h25,27,29-36,38-41H,3-24,26H2,1-2H3/t27-,29+,30+,31-,32-,33+,34-,35+,36+/m0/s1
Std.InChI: InChI=1S/C37H66O8/c1-3-4-5-6-7-8-12-15-18-31(39)35-23-24-36(45-35)33(41)21-20-32(40)34-22-19-30(44-34)17-14-11-9-10-13-16-29(38)26-28-25-27(2)43-37(28)42/h25,27,29-36,38-41H,3-24,26H2,1-2H3/t27-,29+,30+,31-,32-,33+,34-,35+,36+/m0/s1
InChIKey :HKMBLJVHVBJAIH-OVKYLHECBJ
Std.InChIKey: HKMBLJVHVBJAIH-OVKYLHECSA-N
SMILES :CCCCCCCCCC[C@@H]([C@H]1CC[C@@H](O1)[C@@H](CC[C@@H]([C@@H]2CC[C@H](O2)CCCCCCC[C@H](CC3=C[C@@H](OC3=O)C)O)O)O)O
Molar Refractivity :177.80 ± 0.3 cm3 (est)
Parachor :1523.7 ± 6.0 cm3 (est)
Index of Refraction :1.511 ± 0.02 (est)
Surface Tension :43.4 ± 3.0 dyne/cm (est)
Density :1.076 ± 0.06 g/cm3 (est)
Polarizability :70.48 ± 0.5 10-24cm3 (est)