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CHEBI:233274 - 2-acetamido-2-deoxy-α-D-glucopyranosyluronic acid-(1→4)-[2-amino-2-deoxy-β-D-glucopyranosyl-(1→7)]-3-deoxy-α-D-manno-oct-2-ulopyranonosidonic acid-(2→5)-2-(3-amino)propyl-3-deoxy-α-D-manno-oct-2-ulopyranosidonic acid

ChEBI IDCHEBI:233274
ChEBI Name2-acetamido-2-deoxy-α-D-glucopyranosyluronic acid-(1→4)-[2-amino-2-deoxy-β-D-glucopyranosyl-(1→7)]-3-deoxy-α-D-manno-oct-2-ulopyranonosidonic acid-(2→5)-2-(3-amino)propyl-3-deoxy-α-D-manno-oct-2-ulopyranosidonic acid
Stars
ASCII Name2-acetamido-2-deoxy-alpha-D-glucopyranosyluronic acid-(1->4)-[2-amino-2-deoxy-beta-D-glucopyranosyl-(1->7)]-3-deoxy-alpha-D-manno-oct-2-ulopyranonosidonic acid-(2->5)-2-(3-amino)propyl-3-deoxy-alpha-D-manno-oct-2-ulopyranosidonic acid
DefinitionA branched amino tetrasaccharide comprised of a trisaccharide chain of 2-acetamido-2-deoxy-α-D-glucopyranuronic acid, 3-deoxy-α-D-manno-oct-2-ulopyranosonic acid and 3-aminopropyl 3-deoxy-α-D-manno-oct-2-ulopyranosidonic acid residues linked sequentially (1→4) and (2→5). A 2-amino-2-deoxy-β-D-glucopyranose residue is also linked (1→7) to the 3-deoxy-α-D-manno-oct-2-ulopyranosonic acid residue.
Last Modified29 January 2025
SubmitterAdnan
DownloadsMolfile
FormulaC33H55N3O25
Net Charge0
Average Mass893.799
Monoisotopic Mass893.31246
SMILES[H][C@]1([C@@H](CO)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2N)O[C@@](O[C@@H]2[C@H](O)C[C@](OCCCN)(C(=O)O)O[C@]2([H])[C@H](O)CO)(C(=O)O)C[C@@H](O[C@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)[C@H]1O
InChIInChI=1S/C33H55N3O25/c1-10(40)36-17-21(46)22(47)26(27(48)49)58-29(17)55-13-6-33(31(52)53,60-23-11(41)5-32(30(50)51,54-4-2-3-34)59-24(23)12(42)7-37)61-25(19(13)44)15(9-39)57-28-16(35)20(45)18(43)14(8-38)56-28/h11-26,28-29,37-39,41-47H,2-9,34-35H2,1H3,(H,36,40)(H,48,49)(H,50,51)(H,52,53)/t11-,12-,13-,14-,15-,16-,17-,18-,19-,20-,21-,22+,23-,24-,25-,26+,28+,29+,32-,33-/m1/s1
InChIKeyMESSCIHAJFNBRL-JMBQBSIOSA-N
ChEBI Ontology
Outgoing Relation(s)
2-acetamido-2-deoxy-α-D-glucopyranosyluronic acid-(1→4)-[2-amino-2-deoxy-β-D-glucopyranosyl-(1→7)]-3-deoxy-α-D-manno-oct-2-ulopyranonosidonic acid-(2→5)-2-(3-amino)propyl-3-deoxy-α-D-manno-oct-2-ulopyranosidonic acid (CHEBI:233274) is a amino tetrasaccharide (CHEBI:59412)
IUPAC Name 
3-aminopropyl 2-acetamido-2-deoxy-α-D-glucopyranuronosyl-(1→4)-[2-amino-2-deoxy-β-D-glucopyranosyl-(1→7)]-3-deoxy-α-D-manno-oct-2-ulopyranonosyl-(2→5)-3-deoxy-α-D-manno-oct-2-ulopyranosidonic acid
Citations