Description
2′-Cinnamoyl-3′-benzoyl-(2-O-α-glucosyl)-Sucrose is a natural product identified in *Polygala tenuifolia* Willd.
IUPAC Name: [(2R,3R,4S,5S)-2-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4-hydroxy-5-(hydroxymethyl)-2-[[(E)-3-phenylprop-2-enoyl]oxymethyl]oxolan-3-yl] benzoate
InChI: InChI=1S/C34H42O18/c35-13-19-23(39)26(42)28(44)32(47-19)49-29-27(43)24(40)20(14-36)48-33(29)52-34(16-46-22(38)12-11-17-7-3-1-4-8-17)30(25(41)21(15-37)51-34)50-31(45)18-9-5-2-6-10-18/h1-12,19-21,23-30,32-33,35-37,39-44H,13-16H2/b12-11+/t19-,20+,21-,23-,24+,25-,26+,27-,28-,29+,30+,32+,33-,34+/m0/s1
InChIKey: DROBWYUEFJGJMJ-QPPCJNJZSA-N
SMILES: C1=CC=C(C=C1)/C=C/C(=O)OC[C@]2([C@@H]([C@H]([C@@H](O2)CO)O)OC(=O)C3=CC=CC=C3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O[C@@H]5[C@H]([C@@H]([C@H]([C@@H](O5)CO)O)O)O
Synonyms: [(2R,3R,4S,5S)-2-[(2S,3R,4S,5S,6R)-4,5-Dihydroxy-6-(hydroxymethyl)-3-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4-hydroxy-5-(hydroxymethyl)-2-[[(E)-3-phenylprop-2-enoyl]oxymethyl]oxolan-3-yl] benzoate; 154287-55-5; 2′-cinnamoyl-3′-benzoyl-(2-O-; A-glucosyl)-Sucrose
Botanical Source: