neohesperidin dihydrochalcone
Right Click Jmol Molecule For More Options. (Safari 1.2 (v125) Compatible). Jmol is a free download found Here. To Datasheet
IUPAC Name :1-[4-[(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-2,6-dihydroxyphenyl]-3-(3-hydroxy-4-methoxyphenyl)propan-1-one
InChI :InChI=1/C28H36O15/c1-11-21(34)23(36)25(38)27(40-11)43-26-24(37)22(35)19(10-29)42-28(26)41-13-8-16(32)20(17(33)9-13)14(30)5-3-12-4-6-18(39-2)15(31)7-12/h4,6-9,11,19,21-29,31-38H,3,5,10H2,1-2H3/t11-,19+,21-,22+,23+,24-,25+,26+,27-,28+/m0/s1
Std.InChI: InChI=1S/C28H36O15/c1-11-21(34)23(36)25(38)27(40-11)43-26-24(37)22(35)19(10-29)42-28(26)41-13-8-16(32)20(17(33)9-13)14(30)5-3-12-4-6-18(39-2)15(31)7-12/h4,6-9,11,19,21-29,31-38H,3,5,10H2,1-2H3/t11-,19+,21-,22+,23+,24-,25+,26+,27-,28+/m0/s1
Search Google for structures with same skeleton
InChIKey :ITVGXXMINPYUHD-CUVHLRMHBZ
Std.InChIKey: ITVGXXMINPYUHD-CUVHLRMHSA-N
Search Google for exact structure
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]2OC3=CC(=C(C(=C3)O)C(=O)CCC4=CC(=C(C=C4)OC)O)O)CO)O)O)O)O)O
MDL: MFCD00017711
Molar Refractivity :143.85 ± 0.4 cm3 (est)
Parachor :1190.2 ± 6.0 cm3 (est)
Index of Refraction :1.684 ± 0.03 (est)
Surface Tension :97.5 ± 5.0 dyne/cm (est)
Density :1.61 ± 0.1 g/cm3 (est)
Polarizability :57.02 ± 0.5 10-24cm3 (est)