EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C24H42O21 |
| Net Charge | 0 |
| Average Mass | 666.579 |
| Monoisotopic Mass | 666.22186 |
| SMILES | OC[C@H]1O[C@H](O[C@@H]2[C@H](O)[C@@H](OC[C@H]3OC(O)[C@@H](O)[C@@H](O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O)[C@@H]3O)O[C@H](CO)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O |
| WURCS | WURCS=2.0/2,4,3/[a1122h-1x_1-5][a1122h-1a_1-5]/1-2-2-2/a3-b1_a6-c1_c3-d1 |
| InChI | InChI=1S/C24H42O21/c25-1-5-9(28)13(32)15(34)23(42-5)44-19-12(31)8(40-21(38)17(19)36)4-39-22-18(37)20(11(30)7(3-27)41-22)45-24-16(35)14(33)10(29)6(2-26)43-24/h5-38H,1-4H2/t5-,6-,7-,8-,9-,10-,11-,12-,13+,14+,15+,16+,17+,18+,19+,20+,21?,22+,23-,24-/m1/s1 |
| InChIKey | UJTNDTZMGPFFRF-ZNDIOTGLSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| α-D-Manp-(1→3)-α-D-Manp-(1→6)[α-D-Manp-(1→3)]-D-Manp (CHEBI:147776) is a β-D-Manp-(1→4)-β-D-Manp-(1→4)-β-D-Manp-(1→4)-D-Manp (CHEBI:62973) |
| IUPAC Names |
|---|
| Man(a1-3)Man(a1-6)[Man(a1-3)]Man |
| α-D-mannopyranosyl-(1→3)-[α-D-mannopyranosyl-(1→3)-α-D-mannopyranosyl-(1→6)]-D-mannopyranose |
| Synonyms | Source |
|---|---|
| α-D-manno-hexopyranosyl-(1→3)-α-D-manno-hexopyranosyl-(1→6)-[α-D-manno-hexopyranosyl-(1→3)]-D-manno-hexopyranose | IUPAC |
| (2R,3S,4S,5S,6R)-2-[(2R,3R,4S,5S,6S)-3,5-dihydroxy-2-(hydroxymethyl)-6-[[(2R,3R,4S,5S)-3,5,6-trihydroxy-4-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]methoxy]oxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol | IUPAC |