fistuloside A

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InChI :InChI=1/C39H62O13/c1-17-8-11-39(47-16-17)18(2)28-26(52-39)13-23-21-7-6-20-12-25(24(41)14-38(20,5)22(21)9-10-37(23,28)4)49-36-34(32(45)30(43)27(15-40)50-36)51-35-33(46)31(44)29(42)19(3)48-35/h6,17-19,21-36,40-46H,7-16H2,1-5H3
Std.InChI: InChI=1S/C39H62O13/c1-17-8-11-39(47-16-17)18(2)28-26(52-39)13-23-21-7-6-20-12-25(24(41)14-38(20,5)22(21)9-10-37(23,28)4)49-36-34(32(45)30(43)27(15-40)50-36)51-35-33(46)31(44)29(42)19(3)48-35/h6,17-19,21-36,40-46H,7-16H2,1-5H3
InChIKey :JLHNRUIVXOGFRP-UHFFFAOYAJ
Std.InChIKey: JLHNRUIVXOGFRP-UHFFFAOYSA-N
SMILES :CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(CC(C(C6)OC7C(C(C(C(O7)CO)O)O)OC8C(C(C(C(O8)C)O)O)O)O)C)C)C)OC1
Molar Refractivity :186.77 ± 0.4 cm3 (est)
Parachor :1531.8 ± 6.0 cm3 (est)
Index of Refraction :1.614 ± 0.03 (est)
Surface Tension :66.9 ± 5.0 dyne/cm (est)
Density :1.37 ± 0.1 g/cm3 (est)
Polarizability :74.04 ± 0.5 10-24cm3 (est)