EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C18H32O16 |
| Net Charge | 0 |
| Average Mass | 504.438 |
| Monoisotopic Mass | 504.16903 |
| SMILES | OC[C@H]1OC(O[C@H]2[C@H](O)[C@@H](O)[C@@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O)O[C@@H]3CO)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O |
| WURCS | WURCS=2.0/3,3,2/[a2122h-1b_1-5][a2122h-1a_1-5][a2122h-1x_1-5]/1-2-3/a4-b1_b4-c1 |
| InChI | InChI=1S/C18H32O16/c19-1-4-7(22)8(23)12(27)17(31-4)34-15-6(3-21)32-18(13(28)10(15)25)33-14-5(2-20)30-16(29)11(26)9(14)24/h4-29H,1-3H2/t4-,5-,6-,7-,8+,9-,10-,11-,12-,13-,14-,15-,16-,17?,18-/m1/s1 |
| InChIKey | FYGDTMLNYKFZSV-HCJUDOSKSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| D-Glcp-(1→4)-α-D-Glcp-(1→4)-β-D-Glcp (CHEBI:147059) is a glucotriose (CHEBI:146180) |
| D-Glcp-(1→4)-α-D-Glcp-(1→4)-β-D-Glcp (CHEBI:147059) is a partially-defined glycan (CHEBI:146306) |
| Incoming Relation(s) |
| α-D-Glcp-(1→4)-α-D-Glcp-(1→4)-β-D-Glcp (CHEBI:146054) is a D-Glcp-(1→4)-α-D-Glcp-(1→4)-β-D-Glcp (CHEBI:147059) |
| IUPAC Names |
|---|
| Glc(?1-4)Glc(a1-4)b-Glc |
| D-glucopyranosyl-(1→4)-α-D-glucopyranosyl-(1→4)-β-D-glucopyranose |
| Synonyms | Source |
|---|---|
| D-gluco-hexopyranosyl-(1→4)-α-D-gluco-hexopyranosyl-(1→4)-β-D-gluco-hexopyranose | IUPAC |
| (3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol | IUPAC |