Xlfg xyloglucan oligosaccharide

Structural Information

Molecular Formula

C₅₇H₉₆O₄₇

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[C@H]8[C@@H]([C@H]([C@H]([C@H](O8)CO)O)O)O)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)COC1C([C@H](C(CO1)O)O)O)O)O)O)O)O)O)O)CO)O)O)O)O)O

InChI

InChI=1S/C57H96O47/c1-11-21(64)28(71)37(80)50(92-11)103-47-31(74)26(69)16(3-59)95-57(47)104-46-24(67)14(63)7-88-56(46)91-10-20-44(33(76)40(83)53(97-20)99-42-17(4-60)93-48(85)35(78)32(42)75)101-54-41(84)34(77)43(100-52-39(82)30(73)27(70)18(96-52)8-89-49-36(79)22(65)12(61)5-86-49)19(98-54)9-90-55-45(23(66)13(62)6-87-55)102-51-38(81)29(72)25(68)15(2-58)94-51/h11-85H,2-10H2,1H3/t11-,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+,52+,53+,54+,55?,56?,57+/m1/s1

InChIKey

UXLCPUQLASXUCI-YWIPSOFJSA-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)-6-[[(4S)-4,5-dihydroxy-3-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4-dihydroxy-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 54758680