withanolide B

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InChI :InChI=1/C28H38O5/c1-14-13-20(32-25(30)15(14)2)16(3)17-8-9-18-22-19(10-12-26(17,18)4)27(5)21(29)7-6-11-28(27,31)24-23(22)33-24/h6-7,16-20,22-24,31H,8-13H2,1-5H3/t16-,17+,18-,19-,20+,22-,23-,24-,26+,27-,28-/m0/s1
Std.InChI: InChI=1S/C28H38O5/c1-14-13-20(32-25(30)15(14)2)16(3)17-8-9-18-22-19(10-12-26(17,18)4)27(5)21(29)7-6-11-28(27,31)24-23(22)33-24/h6-7,16-20,22-24,31H,8-13H2,1-5H3/t16-,17+,18-,19-,20+,22-,23-,24-,26+,27-,28-/m0/s1
InChIKey :ZTEVDTFJUUJBLP-MBMSZCMEBT
Std.InChIKey: ZTEVDTFJUUJBLP-MBMSZCMESA-N
SMILES :CC1=C(C(=O)O[C@H](C1)[C@@H](C)[C@H]2CC[C@@H]3[C@@]2(CC[C@H]4[C@H]3[C@H]5[C@H](O5)[C@@]6([C@@]4(C(=O)C=CC6)C)O)C)C
MDL: MFCD19053156
Molar Refractivity :123.69 ± 0.3 cm3 (est)
Parachor :983.1 ± 6.0 cm3 (est)
Index of Refraction :1.570 ± 0.02 (est)
Surface Tension :46.3 ± 3.0 dyne/cm (est)
Density :1.206 ± 0.06 g/cm3 (est)
Polarizability :49.03 ± 0.5 10-24cm3 (est)