EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C51H89N5O31 |
| Net Charge | 0 |
| Average Mass | 1268.277 |
| Monoisotopic Mass | 1267.55415 |
| SMILES | CO[C@@H]1[C@@H](O[C@@H]2[C@@H](O[C@@H]3[C@@H](O[C@@H]4[C@@H](O[C@H]5[C@@H](O)[C@H](NC(=O)[C@@H](O)CCO)[C@@H](C)O[C@@H]5O)O[C@H](C)[C@@H](NC(=O)[C@@H](O)CCO)[C@@H]4O)O[C@H](C)[C@@H](NC(=O)[C@@H](O)CCO)[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 |
| InChI | InChI=1S/C51H89N5O31/c1-17-27(52-42(72)22(62)7-12-57)32(67)37(47(77)79-17)84-49-39(34(69)29(19(3)81-49)54-44(74)24(64)9-14-59)86-51-41(36(71)31(21(5)83-51)56-46(76)26(66)11-16-61)87-50-40(35(70)30(20(4)82-50)55-45(75)25(65)10-15-60)85-48-38(78-6)33(68)28(18(2)80-48)53-43(73)23(63)8-13-58/h17-41,47-51,57-71,77H,7-16H2,1-6H3,(H,52,72)(H,53,73)(H,54,74)(H,55,75)(H,56,76)/t17-,18-,19-,20-,21-,22+,23+,24+,25+,26+,27-,28-,29-,30-,31-,32+,33+,34+,35+,36+,37+,38+,39+,40+,41+,47+,48-,49-,50-,51-/m1/s1 |
| InChIKey | RWPJZZSFXPRIME-JRGFUMMTSA-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-(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:59267) 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-(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:59267) is a amino pentasaccharide (CHEBI:59268) |
| 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-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 pentasaccharide | ChEBI |
| 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-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-mannopyranose | ChEBI |
| 4,6-dideoxy-4-{[(2S)-2,4-dihydroxybutanoyl]amino}-2-O-methyl-α-D-Man-(1→2)-4,6-dideoxy-4-{[(2S)-2,4-dihydroxybutanoyl]amino}-α-D-Man-(1→2)-4,6-dideoxy-4-{[(2S)-2,4-dihydroxybutanoyl]amino}-α-D-Man-(1→2)-4,6-dideoxy-4-{[(2S)-2,4-dihydroxybutanoyl]amino}-α-D-Man-(1→2)-4,6-dideoxy-4-{[(2S)-2,4-dihydroxybutanoyl]amino}-α-D-Man | ChEBI |
| Citations |
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