IUPAC Name :(2S)-5,7-dihydroxy-2-[4-[2,4,6-trihydroxy-3-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]-5-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenoxy]phenyl]-2,3-dihydrochromen-4-one
InChI :InChI=1/C36H32O15/c37-14-25-29(43)33(47)34(48)35(51-25)28-30(44)27(20(40)10-3-15-1-6-17(38)7-2-15)31(45)36(32(28)46)49-19-8-4-16(5-9-19)23-13-22(42)26-21(41)11-18(39)12-24(26)50-23/h1-12,23,25,29,33-35,37-39,41,43-48H,13-14H2/b10-3+/t23-,25+,29+,33-,34+,35-/m0/s1
Std.InChI: InChI=1S/C36H32O15/c37-14-25-29(43)33(47)34(48)35(51-25)28-30(44)27(20(40)10-3-15-1-6-17(38)7-2-15)31(45)36(32(28)46)49-19-8-4-16(5-9-19)23-13-22(42)26-21(41)11-18(39)12-24(26)50-23/h1-12,23,25,29,33-35,37-39,41,43-48H,13-14H2/b10-3+/t23-,25+,29+,33-,34+,35-/m0/s1
InChIKey :QAYDNOZSJGIPSH-UJLWYIQBBL
Std.InChIKey: QAYDNOZSJGIPSH-UJLWYIQBSA-N
SMILES :C1[C@H](OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)OC4=C(C(=C(C(=C4O)[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)C(=O)/C=C/C6=CC=C(C=C6)O)O
Molar Refractivity :177.05 ± 0.3 cm3 (est)
Parachor :1345.9 ± 6.0 cm3 (est)
Index of Refraction :1.757 ± 0.02
(est)
Surface Tension :94.8 ± 3.0 dyne/cm (est)
Density :1.633 ± 0.06 g/cm3 (est)
Polarizability :70.18 ± 0.5 10-24cm3 (est)