1-KESTOSE(470-69-9) IR1
Molecular FormulaC18H32O16
Molecular Weight504.44
InChIInChI=1/C19H34O16/c1-2-18(15(28)11(24)8(4-21)32-18)35-30-6-19(16(29)12(25)9(5-22)33-19)34-17-14(27)13(26)10(23)7(3-20)31-17/h7-17,20-29H,2-6H2,1H3/t7-,8-,9-,10-,11-,12-,13+,14-,15+,16+,17-,18+,19+/s3
InChIKey XMQMBYAYWCCFHQ-ZIWOCGEBNA-N
Smiles[C@]1(COO[C@@]2(CC)[C@@H](O)[C@H](O)[C@@H](CO)O2)([C@@H](O)[C@H](O)[C@@H](CO)O1)O[C@@H]1[C@H](O)[C@H]([C@H](O)[C@@H](CO)O1)O |&1:0,4,7,9,11,15,17,19,24,25,27,28,30,r|
KBr disc
