shikonin

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IUPAC Name :5,8-dihydroxy-2-[(1R)-1-hydroxy-4-methylpent-3-enyl]naphthalene-1,4-dione
InChI :InChI=1/C16H16O5/c1-8(2)3-4-10(17)9-7-13(20)14-11(18)5-6-12(19)15(14)16(9)21/h3,5-7,10,17-19H,4H2,1-2H3/t10-/m1/s1
Std.InChI: InChI=1S/C16H16O5/c1-8(2)3-4-10(17)9-7-13(20)14-11(18)5-6-12(19)15(14)16(9)21/h3,5-7,10,17-19H,4H2,1-2H3/t10-/m1/s1
InChIKey :NEZONWMXZKDMKF-SNVBAGLBBQ
Std.InChIKey: NEZONWMXZKDMKF-SNVBAGLBSA-N
SMILES :CC(=CC[C@H](C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O)O)C
MDL: MFCD00016668
Molar Refractivity :75.86 ± 0.3 cm3 (est)
Parachor :596.5 ± 6.0 cm3 (est)
Index of Refraction :1.642 ± 0.02 (est)
Surface Tension :65.1 ± 3.0 dyne/cm (est)
Density :1.373 ± 0.06 g/cm3 (est)
Polarizability :30.07 ± 0.5 10-24cm3 (est)