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]1O[C@H](OC[C@H]2O[C@@H](OC[C@H]3OC(O)[C@H](O)[C@@H](O)[C@@H]3O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O |
| WURCS | WURCS=2.0/3,3,2/[a2122h-1x_1-5][a2122h-1b_1-5][a2122h-1a_1-5]/1-2-3/a6-b1_b6-c1 |
| InChI | InChI=1S/C18H32O16/c19-1-4-7(20)11(24)14(27)17(33-4)31-3-6-9(22)12(25)15(28)18(34-6)30-2-5-8(21)10(23)13(26)16(29)32-5/h4-29H,1-3H2/t4-,5-,6-,7-,8-,9-,10+,11+,12+,13-,14-,15-,16?,17+,18-/m1/s1 |
| InChIKey | FBJQEBRMDXPWNX-ULTMSREBSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| α-D-Glcp-(1→6)-β-D-Glcp-(1→6)-D-Glcp (CHEBI:148308) has functional parent gentiobiose (CHEBI:28066) |
| α-D-Glcp-(1→6)-β-D-Glcp-(1→6)-D-Glcp (CHEBI:148308) is a glucotriose (CHEBI:146180) |
| IUPAC Names |
|---|
| Glc(a1-6)Glc(b1-6)Glc |
| α-D-glucopyranosyl-(1→6)-β-D-glucopyranosyl-(1→6)-D-glucopyranose |
| Synonyms | Source |
|---|---|
| α-D-gluco-hexopyranosyl-(1→6)-β-D-gluco-hexopyranosyl-(1→6)-D-gluco-hexopyranose | IUPAC |
| (3R,4S,5S,6R)-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]oxane-2,3,4,5-tetrol | IUPAC |
| Citations |
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