isoannonacin A

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IUPAC Name :(5S)-5-[(6R,11R)-6,11-dihydroxy-11-[(2R,5R)-5-[(1R)-1-hydroxytridecyl]oxolan-2-yl]undecyl]-3-(2-oxopropyl)oxolan-2-one
InChI :InChI=1/C35H64O7/c1-3-4-5-6-7-8-9-10-11-15-21-31(38)33-23-24-34(42-33)32(39)22-17-16-19-29(37)18-13-12-14-20-30-26-28(25-27(2)36)35(40)41-30/h28-34,37-39H,3-26H2,1-2H3/t28?,29-,30+,31-,32-,33-,34-/m1/s1
Std.InChI: InChI=1S/C35H64O7/c1-3-4-5-6-7-8-9-10-11-15-21-31(38)33-23-24-34(42-33)32(39)22-17-16-19-29(37)18-13-12-14-20-30-26-28(25-27(2)36)35(40)41-30/h28-34,37-39H,3-26H2,1-2H3/t28?,29-,30+,31-,32-,33-,34-/m1/s1
InChIKey :DGQPZGGOYKKJLX-INIGWUGFBW
Std.InChIKey: DGQPZGGOYKKJLX-INIGWUGFSA-N
SMILES :CCCCCCCCCCCC[C@H]([C@H]1CC[C@@H](O1)[C@@H](CCCC[C@@H](CCCCC[C@H]2CC(C(=O)O2)CC(=O)C)O)O)O
Molar Refractivity :167.92 ± 0.3 cm3 (est)
Parachor :1461.1 ± 6.0 cm3 (est)
Index of Refraction :1.493 ± 0.02 (est)
Surface Tension :40.9 ± 3.0 dyne/cm (est)
Density :1.033 ± 0.06 g/cm3 (est)
Polarizability :66.56 ± 0.5 10-24cm3 (est)