Xxfg xyloglucan oligosaccharide

Structural Information

Molecular Formula

C₅₁H₈₆O₄₂

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[C@H](C(COC3OC[C@@H]4[C@H]([C@@H]([C@H]([C@@H](O4)O[C@@H]5[C@H](O[C@H]([C@@H]([C@H]5O)O)O)CO)O)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)COC7C([C@H](C(CO7)O)O)O)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)COC9C([C@H](C(CO9)O)O)O)O)O)O)O)O)O)O)CO)O)O)O)O)O

InChI

InChI=1S/C51H86O42/c1-10-19(57)25(63)34(72)46(83-10)92-42-27(65)23(61)14(2-52)85-51(42)93-41-22(60)13(56)6-79-50(41)82-9-18-40(29(67)36(74)48(88-18)89-38-15(3-53)84-43(76)31(69)28(38)66)91-49-37(75)30(68)39(17(87-49)8-81-45-33(71)21(59)12(55)5-78-45)90-47-35(73)26(64)24(62)16(86-47)7-80-44-32(70)20(58)11(54)4-77-44/h10-76H,2-9H2,1H3/t10-,11?,12?,13?,14-,15-,16-,17-,18-,19+,20+,21+,22+,23+,24-,25+,26+,27+,28-,29-,30-,31-,32?,33?,34-,35-,36-,37-,38-,39-,40-,41?,42-,43-,44?,45?,46+,47+,48+,49+,50?,51+/m1/s1

InChIKey

IKYMUPZUAJOZHC-NDKUYQLLSA-N

Compound name

(2S,3R,4S,5R,6R)-2-[(2S,3R,4S,5R,6R)-2-[(4S)-2-[[(2R,3S,4R,5R,6S)-3-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-[[(4S)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(4S)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxy-6-[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-2-yl]methoxy]-4,5-dihydroxyoxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-methyloxane-3,4,5-triol

Related CIDs

• CID 54758633