steviol
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IUPAC Name :(1R,4S,5R,9S,10R,13S)-13-hydroxy-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid
InChI :InChI=1/C20H30O3/c1-13-11-19-9-5-14-17(2,7-4-8-18(14,3)16(21)22)15(19)6-10-20(13,23)12-19/h14-15,23H,1,4-12H2,2-3H3,(H,21,22)/t14?,15?,17-,18+,19-,20+/m0/s1
Std.InChI: InChI=1S/C20H30O3/c1-13-11-19-9-5-14-17(2,7-4-8-18(14,3)16(21)22)15(19)6-10-20(13,23)12-19/h14-15,23H,1,4-12H2,2-3H3,(H,21,22)/t14?,15?,17-,18+,19-,20+/m0/s1
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InChIKey :QFVOYBUQQBFCRH-PSTIQQKOBL
Std.InChIKey: QFVOYBUQQBFCRH-PSTIQQKOSA-N
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SMILES :C[C@]12CCC[C@@](C1CC[C@@]34C2CC[C@@](C3)(C(=C)C4)O)(C)C(=O)O
MDL: MFCD20441965
Molar Refractivity :89.19 ± 0.4 cm3 (est)
Parachor :718.9 ± 6.0 cm3 (est)
Index of Refraction :1.569 ± 0.03 (est)
Surface Tension :48.7 ± 3.0 dyne/cm (est)
Density :1.17 ± 0.1 g/cm3 (est)
Polarizability :35.36 ± 0.5 10-24cm3 (est)