EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C20H35NO18S |
| Net Charge | 0 |
| Average Mass | 609.556 |
| Monoisotopic Mass | 609.15748 |
| SMILES | CC(=O)N[C@@H]1[C@@H](O[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)[C@H](O[C@@H]2O[C@H](CO)[C@H](OS(=O)(=O)O)[C@H](O)[C@H]2O)[C@@H](CO)O[C@H]1O |
| WURCS | WURCS=2.0/3,3,2/[a2122h-1b_1-5_2*NCC/3=O][a1221m-1a_1-5][a2112h-1b_1-5_4*OSO/3=O/3=O]/1-2-3/a3-b1_a4-c1 |
| InChI | InChI=1S/C20H35NO18S/c1-5-10(25)11(26)13(28)19(34-5)38-17-9(21-6(2)24)18(30)35-8(4-23)16(17)37-20-14(29)12(27)15(7(3-22)36-20)39-40(31,32)33/h5,7-20,22-23,25-30H,3-4H2,1-2H3,(H,21,24)(H,31,32,33)/t5-,7+,8+,9+,10+,11+,12+,13-,14+,15-,16+,17+,18+,19-,20-/m0/s1 |
| InChIKey | PTKPGKZFSBTMGP-QHNPANPUSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| α-L-Fucp-(1→3)-[β-D-Galp4S-(1→4)]-β-D-GlcpNAc (CHEBI:147137) is a amino trisaccharide (CHEBI:59266) |
| α-L-Fucp-(1→3)-[β-D-Galp4S-(1→4)]-β-D-GlcpNAc (CHEBI:147137) is a oligosaccharide sulfate (CHEBI:37909) |
| IUPAC Names |
|---|
| Fuc(a1-3)[Gal4S(b1-4)]b-GlcNAc |
| 6-deoxy-α-L-galactopyranosyl-(1→3)-[4-O-sulfo-β-D-galactopyranosyl-(1→4)]-2-acetamido-2-deoxy-β-D-glucopyranose |
| α-L-fucopyranosyl-(1→3)-[4-O-sulfo-β-D-galactopyranosyl-(1→4)]-2-acetamido-2-deoxy-β-D-glucopyranose |
| Synonyms | Source |
|---|---|
| 6-deoxy-α-L-galacto-hexopyranosyl-(1→3)-[4-O-sulfo-β-D-galacto-hexopyranosyl-(1→4)]-2-acetamido-2-deoxy-β-D-gluco-hexopyranose | IUPAC |
| [(2R,3R,4R,5R,6S)-6-[(2R,3S,4R,5R,6R)-5-acetamido-6-hydroxy-2-(hydroxymethyl)-4-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl] hydrogen sulfate | IUPAC |