EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| 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]4O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]4O)[C@@H](O)C(O)O[C@@H]3CO)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O |
| WURCS | WURCS=2.0/4,5,4/[a2122h-1x_1-5][a1221m-1a_1-5][a2112h-1b_1-5][a2122h-1b_1-5_2*NCC/3=O]/1-2-3-4-3/a3-b1_a4-c1_c3-d1_d3-e1 |
| InChI | InChI=1S/C32H55NO25/c1-7-14(39)18(43)20(45)30(50-7)58-27-22(47)28(49)51-12(6-37)24(27)55-32-23(48)26(17(42)11(5-36)54-32)57-29-13(33-8(2)38)25(16(41)10(4-35)52-29)56-31-21(46)19(44)15(40)9(3-34)53-31/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 | FGJTXYWKOHAINP-MEFWOEMMSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | milk (BTO:0000868) | PubMed (26613816) |
| Roles Classification |
|---|
| Biological Role: | human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6-deoxy-α-L-galactopyranosyl-(1→3)-[β-D-galactopyranosyl-(1→3)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→3)-β-D-galactopyranosyl-(1→4)]-D-glucopyranose (CHEBI:151405) has role human metabolite (CHEBI:77746) |
| 6-deoxy-α-L-galactopyranosyl-(1→3)-[β-D-galactopyranosyl-(1→3)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→3)-β-D-galactopyranosyl-(1→4)]-D-glucopyranose (CHEBI:151405) is a amino pentasaccharide (CHEBI:59268) |
| IUPAC Name |
|---|
| 6-deoxy-α-L-galactopyranosyl-(1→3)-[β-D-galactopyranosyl-(1→3)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→3)-β-D-galactopyranosyl-(1→4)]-D-glucopyranose |
| Synonyms | Source |
|---|---|
| Gal(b1-3)GlcNAc(b1-3)Gal(b1-4)[Fuc(a1-3)]Glc | SUBMITTER |
| β-D-galacto-hexopyranosyl-(1→3)-2-acetamido-2-deoxy-β-D-gluco-hexopyranosyl-(1→3)-β-D-galacto-hexopyranosyl-(1→4)-[6-deoxy-α-L-galacto-hexopyranosyl-(1→3)]-D-gluco-hexopyranose | SUBMITTER |
| LNFP V | ChEBI |
| lacto-N-fucopentaose V | ChEBI |
| Gal(β1→3)GlcNAc(β1→3)Gal(β1→4)[Fuc(α1→3)]Glc | ChEBI |
| LNFP-V | ChEBI |
| Citations |
|---|