dehydroagastol

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IUPAC Name :(2S,4aS,10aS)-5,8-dihydroxy-6-methoxy-2,4a-dimethyl-1-methylidene-7-prop-1-en-2-yl-3,4,10,10a-tetrahydro-2H-phenanthren-9-one
InChI :InChI=1/C21H26O4/c1-10(2)15-18(23)16-14(22)9-13-12(4)11(3)7-8-21(13,5)17(16)19(24)20(15)25-6/h11,13,23-24H,1,4,7-9H2,2-3,5-6H3/t11-,13-,21-/m0/s1
Std.InChI: InChI=1S/C21H26O4/c1-10(2)15-18(23)16-14(22)9-13-12(4)11(3)7-8-21(13,5)17(16)19(24)20(15)25-6/h11,13,23-24H,1,4,7-9H2,2-3,5-6H3/t11-,13-,21-/m0/s1
InChIKey :YAYJIXJFUFMWFD-KDKPCJNHBA
Std.InChIKey: YAYJIXJFUFMWFD-KDKPCJNHSA-N
SMILES :O=C3c1c(c(O)c(OC)c(\C(=C)C)c1O)[C@@]2([C@H](/C(=C)[C@H](CC2)C)C3)C
Molar Refractivity :96.06 ± 0.4 cm3 (est)
Parachor :759.2 ± 6.0 cm3 (est)
Index of Refraction :1.588 ± 0.03 (est)
Surface Tension :50.0 ± 5.0 dyne/cm (est)
Density :1.19 ± 0.1 g/cm3 (est)
Polarizability :38.08 ± 0.5 10-24cm3 (est)