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CHEBI:52982 - 4,6-dideoxy-4-(3-deoxy-L-glycero-tetronamido)-α-D-Manp2Me-(1→2)-4,6-dideoxy-4-(3-deoxy-L-glycero-tetronamido)-α-D-Manp-(1→2)-4,6-dideoxy-4-(3-deoxy-L-glycero-tetronamido)-α-D-Manp

ChEBI IDCHEBI:52982
ChEBI Name4,6-dideoxy-4-(3-deoxy-L-glycero-tetronamido)-α-D-Manp2Me-(1→2)-4,6-dideoxy-4-(3-deoxy-L-glycero-tetronamido)-α-D-Manp-(1→2)-4,6-dideoxy-4-(3-deoxy-L-glycero-tetronamido)-α-D-Manp
Stars
ASCII Name4,6-dideoxy-4-(3-deoxy-L-glycero-tetronamido)-alpha-D-Manp2Me-(1->2)-4,6-dideoxy-4-(3-deoxy-L-glycero-tetronamido)-alpha-D-Manp-(1->2)-4,6-dideoxy-4-(3-deoxy-L-glycero-tetronamido)-alpha-D-Manp
DefinitionAn amido trisaccharide fragment which mimicks the terminus of the O-polysaccharide of Vibrio cholerae O:1, serotype Ogawa.
Secondary ChEBI IDsCHEBI:52952, CHEBI:52981, CHEBI:59264
Last Modified17 May 2010
SubmitterMarcus Ennis, Steve
DownloadsMolfile
FormulaC31H55N3O19
Net Charge0
Average Mass773.783
Monoisotopic Mass773.34298
SMILESCO[C@@H]1[C@@H](O[C@@H]2[C@@H](O[C@H]3[C@@H](O)[C@H](NC(=O)[C@@H](O)CCO)[C@@H](C)O[C@@H]3O)O[C@H](C)[C@@H](NC(=O)[C@@H](O)CCO)[C@@H]2O)O[C@H](C)[C@@H](NC(=O)[C@@H](O)CCO)[C@@H]1O
InChIInChI=1S/C31H55N3O19/c1-11-17(32-26(44)14(38)5-8-35)20(41)23(29(47)49-11)52-31-25(22(43)19(13(3)51-31)34-28(46)16(40)7-10-37)53-30-24(48-4)21(42)18(12(2)50-30)33-27(45)15(39)6-9-36/h11-25,29-31,35-43,47H,5-10H2,1-4H3,(H,32,44)(H,33,45)(H,34,46)/t11-,12-,13-,14+,15+,16+,17-,18-,19-,20+,21+,22+,23+,24+,25+,29+,30-,31-/m1/s1
InChIKeyQLIUTTKWFPAPOF-BUMMBSEUSA-N
ChEBI Ontology
Outgoing Relation(s)
4,6-dideoxy-4-(3-deoxy-L-glycero-tetronamido)-α-D-Manp2Me-(1→2)-4,6-dideoxy-4-(3-deoxy-L-glycero-tetronamido)-α-D-Manp-(1→2)-4,6-dideoxy-4-(3-deoxy-L-glycero-tetronamido)-α-D-Manp (CHEBI:52982) has functional parent α-D-mannose (CHEBI:28729)
4,6-dideoxy-4-(3-deoxy-L-glycero-tetronamido)-α-D-Manp2Me-(1→2)-4,6-dideoxy-4-(3-deoxy-L-glycero-tetronamido)-α-D-Manp-(1→2)-4,6-dideoxy-4-(3-deoxy-L-glycero-tetronamido)-α-D-Manp (CHEBI:52982) is a amino trisaccharide (CHEBI:59266)
IUPAC Name 
4,6-dideoxy-4-[(2S)-2,4-dihydroxybutanamido]-2-O-methyl-α-D-mannopyranosyl-(1→2)-4,6-dideoxy-4-[(2S)-2,4-dihydroxybutanamido]-α-D-mannopyranosyl-(1→2)-4,6-dideoxy-4-[(2S)-2,4-dihydroxybutanamido]-α-D-mannopyranose
Synonyms  Source
Vibrio Cholerae O1, serotype Ogawa trisaccharideChEBI
4,6-dideoxy-4-(3-deoxy-L-glycero-tetronamido)-2-O-methyl-α-D-mannopyranosyl-(1→2)-4,6-dideoxy-4-(3-deoxy-L-glycero-tetronamido)-α-D-mannopyranosyl-(1→2)-4,6-dideoxy-4-(3-deoxy-L-glycero-tetronamido)-α-D-mannopyranoseChEBI
Citations