IUPAC Name :5,7-dihydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one
InChI :InChI=1/C27H30O10/c1-12(2)5-10-16-17(28)11-18(29)19-21(31)26(37-27-23(33)22(32)20(30)13(3)35-27)24(36-25(16)19)14-6-8-15(34-4)9-7-14/h5-9,11,13,20,22-23,27-30,32-33H,10H2,1-4H3/t13-,20-,22+,23+,27-/m0/s1
Std.InChI: InChI=1S/C27H30O10/c1-12(2)5-10-16-17(28)11-18(29)19-21(31)26(37-27-23(33)22(32)20(30)13(3)35-27)24(36-25(16)19)14-6-8-15(34-4)9-7-14/h5-9,11,13,20,22-23,27-30,32-33H,10H2,1-4H3/t13-,20-,22+,23+,27-/m0/s1
InChIKey :NGMYNFJANBHLKA-LVKFHIPRBY
Std.InChIKey: NGMYNFJANBHLKA-LVKFHIPRSA-N
SMILES :C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=C(OC3=C(C2=O)C(=CC(=C3CC=C(C)C)O)O)C4=CC=C(C=C4)OC)O)O)O
MDL: MFCD15071140
Molar Refractivity :130.58 ± 0.4 cm3 (est)
Parachor :1035.9 ± 6.0 cm3 (est)
Index of Refraction :1.666 ± 0.03
(est)
Surface Tension :75.7 ± 5.0 dyne/cm (est)
Density :1.46 ± 0.1 g/cm3 (est)
Polarizability :51.76 ± 0.5 10-24cm3 (est)