IUPAC Name :(2S)-7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5-hydroxy-2,3-dihydrochromen-4-one
InChI :InChI=1/C27H32O15/c1-9-20(33)22(35)24(37)26(38-9)42-25-23(36)21(34)18(8-28)41-27(25)39-11-5-14(31)19-15(32)7-16(40-17(19)6-11)10-2-3-12(29)13(30)4-10/h2-6,9,16,18,20-31,33-37H,7-8H2,1H3/t9-,16-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1
Std.InChI: InChI=1S/C27H32O15/c1-9-20(33)22(35)24(37)26(38-9)42-25-23(36)21(34)18(8-28)41-27(25)39-11-5-14(31)19-15(32)7-16(40-17(19)6-11)10-2-3-12(29)13(30)4-10/h2-6,9,16,18,20-31,33-37H,7-8H2,1H3/t9-,16-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1
InChIKey :OBKKEZLIABHSGY-DOYQYKRZBY
Std.InChIKey: OBKKEZLIABHSGY-DOYQYKRZSA-N
SMILES :C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2Oc3cc(c4c(c3)O[C@@H](CC4=O)c5ccc(c(c5)O)O)O)CO)O)O)O)O)O
MDL: MFCD00017474
Molar Refractivity :137.16 ± 0.4 cm3 (est)
Parachor :1118.6 ± 6.0 cm3 (est)
Index of Refraction :1.727 ± 0.03
(est)
Surface Tension :111.1 ± 5.0 dyne/cm (est)
Density :1.73 ± 0.1 g/cm3 (est)
Polarizability :54.37 ± 0.5 10-24cm3 (est)