EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C32H55NO25 |
| Net Charge | 0 |
| Average Mass | 853.774 |
| Monoisotopic Mass | 853.30632 |
| 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](O)O[C@H](CO)[C@H]3O)[C@@H]2O)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H]1O[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1O |
| WURCS | WURCS=2.0/4,5,4/[a2122h-1b_1-5][a2112h-1b_1-5][a2122h-1b_1-5_2*NCC/3=O][a1221m-1a_1-5]/1-2-3-4-2/a3-b1_b3-c1_c3-d1_c4-e1 |
| InChI | InChI=1S/C32H55NO25/c1-7-14(39)18(43)20(45)30(50-7)56-25-13(33-8(2)38)29(54-12(6-37)24(25)55-31-21(46)19(44)15(40)9(3-34)52-31)57-27-17(42)11(5-36)53-32(23(27)48)58-26-16(41)10(4-35)51-28(49)22(26)47/h7,9-32,34-37,39-49H,3-6H2,1-2H3,(H,33,38)/t7-,9+,10+,11+,12+,13+,14+,15-,16+,17-,18+,19-,20-,21+,22+,23+,24+,25+,26-,27-,28+,29-,30-,31-,32-/m0/s1 |
| InChIKey | BCRMTPAFXLUMRK-GIMWQEQASA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4S,5R,6S)-3,5-Dihydroxy-2-(hydroxymethyl)-6-[(2R,3R,4S,5R,6R)-2,3,5-trihydroxy-6-(hydroxymethyl)oxan-4-yl]oxyoxan-4-yl]oxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]acetamide (CHEBI:154481) is a oligosaccharide (CHEBI:50699) |
| Synonyms | Source |
|---|---|
| 6-deoxy-alpha-L-galacto-hexopyranosyl-(1->3)-[beta-D-galacto-hexopyranosyl-(1->4)]-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->3)-beta-D-galacto-hexopyranosyl-(1->3)-beta-D-gluco-hexopyranose | SUBMITTER |
| Fuc(a1-3)[Gal(b1-4)]GlcNAc(b1-3)Gal(b1-3)b-Glc | SUBMITTER |