neoschaftoside

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IUPAC Name :5,7-dihydroxy-2-(4-hydroxyphenyl)-6-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-8-[(2R,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]chromen-4-one
InChI :InChI=1/C26H28O14/c27-6-13-18(32)21(35)23(37)26(40-13)15-19(33)14-10(29)5-12(8-1-3-9(28)4-2-8)39-24(14)16(20(15)34)25-22(36)17(31)11(30)7-38-25/h1-5,11,13,17-18,21-23,25-28,30-37H,6-7H2/t11-,13+,17-,18+,21-,22+,23+,25+,26-/m0/s1
Std.InChI: InChI=1S/C26H28O14/c27-6-13-18(32)21(35)23(37)26(40-13)15-19(33)14-10(29)5-12(8-1-3-9(28)4-2-8)39-24(14)16(20(15)34)25-22(36)17(31)11(30)7-38-25/h1-5,11,13,17-18,21-23,25-28,30-37H,6-7H2/t11-,13+,17-,18+,21-,22+,23+,25+,26-/m0/s1
InChIKey :MMDUKUSNQNWVET-LQYCTPBQBF
Std.InChIKey: MMDUKUSNQNWVET-LQYCTPBQSA-N
SMILES :C1[C@@H]([C@@H]([C@H]([C@H](O1)C2=C(C(=C(C3=C2OC(=CC3=O)C4=CC=C(C=C4)O)O)[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)O)O)O
Molar Refractivity :131.33 ± 0.3 cm3 (est)
Parachor :1041.0 ± 6.0 cm3 (est)
Index of Refraction :1.758 ± 0.02 (est)
Surface Tension :112.6 ± 3.0 dyne/cm (est)
Density :1.766 ± 0.06 g/cm3 (est)
Polarizability :52.06 ± 0.5 10-24cm3 (est)