EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C44H75NO34 |
| Net Charge | 0 |
| Average Mass | 1162.057 |
| Monoisotopic Mass | 1161.41705 |
| SMILES | CC(=O)N[C@H]1[C@H](O[C@H]2[C@@H](O)[C@@H](CO)O[C@@H](O[C@H]3[C@H](O[C@@H]4O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]4O)[C@@H](O)C(O)O[C@@H]3CO)[C@@H]2O)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H]2O)[C@@H]1O[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1O |
| WURCS | WURCS=2.0/5,7,6/[a2122h-1x_1-5][a1221m-1a_1-5][a2112h-1b_1-5][a2122h-1b_1-5_2*NCC/3=O][a2112h-1a_1-5]/1-2-3-4-2-3-5/a3-b1_a4-c1_c3-d1_d3-e1_d4-f1_f3-g1 |
| InChI | InChI=1S/C44H75NO34/c1-9-18(52)23(57)26(60)40(67-9)76-34-17(45-11(3)51)39(73-16(8-50)32(34)74-43-31(65)36(22(56)14(6-48)71-43)78-42-28(62)25(59)20(54)12(4-46)70-42)77-35-21(55)13(5-47)72-44(30(35)64)75-33-15(7-49)69-38(66)29(63)37(33)79-41-27(61)24(58)19(53)10(2)68-41/h9-10,12-44,46-50,52-66H,4-8H2,1-3H3,(H,45,51)/t9-,10-,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-/m0/s1 |
| InChIKey | MVXZIFWICWFWLY-SXBWCNGISA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(2S,3R,4R,5S,6R)-5-[(2S,3R,4S,5S,6R)-3,5-Dihydroxy-6-(hydroxymethyl)-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-[(2S,3R,4S,5S,6R)-2-[(2R,3R,4R,5R)-5,6-dihydroxy-2-(hydroxymethyl)-4-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-6-(hydroxymethyl)-4-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]acetamide (CHEBI:149055) is a oligosaccharide (CHEBI:50699) |
| Synonyms | Source |
|---|---|
| Gal(a1-3)Gal(b1-4)[Fuc(a1-3)]GlcNAc(b1-3)Gal(b1-4)[Fuc(a1-3)]Glc | SUBMITTER |
| alpha-D-galacto-hexopyranosyl-(1->3)-beta-D-galacto-hexopyranosyl-(1->4)-[6-deoxy-alpha-L-galacto-hexopyranosyl-(1->3)]-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->3)-beta-D-galacto-hexopyranosyl-(1->4)-[6-deoxy-alpha-L-galacto-hexopyranosyl-(1->3)]-D-gluco-hexopyranose | SUBMITTER |