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CHEBI:133867 - 4-O-[di(2R)-1-glycerylphosphonato]-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosaminyl undecaprenyl diphosphate(4−)
| Formula | C77H128N2O27P4 |
| Net Charge | -4 |
| Average Mass | 1637.754 |
| Monoisotopic Mass | 1636.76769 |
| SMILES | CC(=O)N[C@@H]1[C@H](O[C@H]2[C@H](O)[C@@H](NC(C)=O)[C@@H](OP(=O)([O-])OP(=O)([O-])OC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C)O[C@@H]2CO)O[C@H](CO)[C@@H](OP(=O)([O-])OC[C@H](O)COP(=O)([O-])OC[C@H](O)CO)[C@@H]1O |
| InChI | InChI=1S/C77H132N2O27P4/c1-53(2)25-15-26-54(3)27-16-28-55(4)29-17-30-56(5)31-18-32-57(6)33-19-34-58(7)35-20-36-59(8)37-21-38-60(9)39-22-40-61(10)41-23-42-62(11)43-24-44-63(12)45-46-97-109(93,94)106-110(95,96)105-77-71(79-65(14)84)72(87)74(68(48-81)102-77)103-76-70(78-64(13)83)73(88)75(69(49-82)101-76)104-108(91,92)100-52-67(86)51-99-107(89,90)98-50-66(85)47-80/h25,27,29,31,33,35,37,39,41,43,45,66-77,80-82,85-88H,15-24,26,28,30,32,34,36,38,40,42,44,46-52H2,1-14H3,(H,78,83)(H,79,84)(H,89,90)(H,91,92)(H,93,94)(H,95,96)/p-4/b54-27+,55-29+,56-31-,57-33-,58-35-,59-37-,60-39-,61-41-,62-43-,63-45-/t66-,67-,68-,69-,70+,71-,72-,73-,74-,75-,76+,77-/m1/s1 |
| InChIKey | XTZSKDGCELJMAX-RVJRVLLYSA-J |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-O-[di(2R)-1-glycerylphosphonato]-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosaminyl undecaprenyl diphosphate(4−) (CHEBI:133867) is a organophosphate oxoanion (CHEBI:58945) |
| 4-O-[di(2R)-1-glycerylphosphonato]-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosaminyl undecaprenyl diphosphate(4−) (CHEBI:133867) is conjugate base of 4-O-[di(2R)-1-glycerylphosphono]-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosaminyl undecaprenyl diphosphate (CHEBI:136078) |
| Incoming Relation(s) |
| 4-O-[di(2R)-1-glycerylphosphono]-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosaminyl undecaprenyl diphosphate (CHEBI:136078) is conjugate acid of 4-O-[di(2R)-1-glycerylphosphonato]-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosaminyl undecaprenyl diphosphate(4−) (CHEBI:133867) |
| IUPAC Name |
|---|
| 2-acetamido-4-O-(2-acetamido-2-deoxy-4-O-{[(2R)-3-({[(2R)-2,3-dihydroxypropoxy]phosphinato}oxy)-2-hydroxypropoxy]phosphinato}-β-D-mannopyranosyl)-2-deoxy-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphinato)oxy]phosphinato}-α-D-glucopyranose |
| UniProt Name | Source |
|---|---|
| 4-O-[di(2R)-glycerylphospho]-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate | UniProt |
| Manual Xrefs | Databases |
|---|---|
| CPD-19301 | MetaCyc |
| Citations |
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