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CHEBI:157137 - (3R,4S,5S,6R)-3-[(2S,3R,4S,5S,6R)-3-[(2S,3R,4S,5S,6R)-3-[(2S,3R,4S,5S,6R)-3-[(2S,3R,4S,5S,6R)-3-[(2S,3R,4S,5S,6R)-3-[(2S,3R,4S,5S,6R)-4,5-Dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)oxane-2,4,5-triol

Default Structure
ChEBI IDCHEBI:157137
ChEBI Name(3R,4S,5S,6R)-3-[(2S,3R,4S,5S,6R)-3-[(2S,3R,4S,5S,6R)-3-[(2S,3R,4S,5S,6R)-3-[(2S,3R,4S,5S,6R)-3-[(2S,3R,4S,5S,6R)-3-[(2S,3R,4S,5S,6R)-4,5-Dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)oxane-2,4,5-triol
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC48H82O41
Net Charge0
Average Mass1315.143
Monoisotopic Mass1314.43315
SMILESOC[C@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3[C@H](O[C@H]4[C@H](O[C@H]5[C@H](O[C@H]6[C@H](O[C@H]7[C@H](O[C@H]8C(O)O[C@H](CO)[C@@H](O)[C@@H]8O)O[C@H](CO)[C@@H](O)[C@@H]7O)O[C@H](CO)[C@@H](O)[C@@H]6O)O[C@H](CO)[C@@H](O)[C@@H]5O)O[C@H](CO)[C@@H](O)[C@@H]4O)O[C@H](CO)[C@@H](O)[C@@H]3O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
WURCSWURCS=2.0/2,8,7/[a2122h-1x_1-5][a2122h-1b_1-5]/1-2-2-2-2-2-2-2/a2-b1_b2-c1_c2-d1_d2-e1_e2-f1_f2-g1_g2-h1
InChIInChI=1S/C48H82O41/c49-1-9-18(58)26(66)34(41(74)75-9)83-43-36(28(68)20(60)11(3-51)77-43)85-45-38(30(70)22(62)13(5-53)79-45)87-47-40(32(72)24(64)15(7-55)81-47)89-48-39(31(71)23(63)16(8-56)82-48)88-46-37(29(69)21(61)14(6-54)80-46)86-44-35(27(67)19(59)12(4-52)78-44)84-42-33(73)25(65)17(57)10(2-50)76-42/h9-74H,1-8H2/t9-,10-,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+/m1/s1
InChIKeyHFVSWHIVYSDIJB-NXIYSJIESA-N
ChEBI Ontology
Outgoing Relation(s)
(3R,4S,5S,6R)-3-[(2S,3R,4S,5S,6R)-3-[(2S,3R,4S,5S,6R)-3-[(2S,3R,4S,5S,6R)-3-[(2S,3R,4S,5S,6R)-3-[(2S,3R,4S,5S,6R)-3-[(2S,3R,4S,5S,6R)-4,5-Dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)oxane-2,4,5-triol (CHEBI:157137) is a carbohydrates and carbohydrate derivatives (CHEBI:78616)
Synonyms  Source
beta-D-gluco-hexopyranosyl-(1->2)-beta-D-gluco-hexopyranosyl-(1->2)-beta-D-gluco-hexopyranosyl-(1->2)-beta-D-gluco-hexopyranosyl-(1->2)-beta-D-gluco-hexopyranosyl-(1->2)-beta-D-gluco-hexopyranosyl-(1->2)-beta-D-gluco-hexopyranosyl-(1->2)-D-gluco-hexopyranoseSUBMITTER
Glc(b1-2)Glc(b1-2)Glc(b1-2)Glc(b1-2)Glc(b1-2)Glc(b1-2)Glc(b1-2)GlcSUBMITTER
Manual XrefsDatabases
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