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CHEBI:15696 - β-D-glucosyl-(1→4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate

ChEBI IDCHEBI:15696
ChEBI Nameβ-D-glucosyl-(1→4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate
Stars
ASCII Namebeta-D-glucosyl-(1->4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate
DefinitionA polyprenyl glycosyl diphosphate having eleven prenyl units and with β-D-glucosyl-(1→4)-N-acetyl-D-glucosamine as the glycosyl fragment.
Secondary ChEBI IDsCHEBI:10401, CHEBI:12376, CHEBI:22799
Last Modified29 July 2016
DownloadsMolfile
FormulaC69H115NO17P2
Net Charge0
Average Mass1292.617
Monoisotopic Mass1291.76402
SMILESCC(=O)N[C@H]1C(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](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1O
InChIInChI=1S/C69H115NO17P2/c1-48(2)24-14-25-49(3)26-15-27-50(4)28-16-29-51(5)30-17-31-52(6)32-18-33-53(7)34-19-35-54(8)36-20-37-55(9)38-21-39-56(10)40-22-41-57(11)42-23-43-58(12)44-45-82-88(78,79)87-89(80,81)86-68-62(70-59(13)73)64(75)67(61(47-72)84-68)85-69-66(77)65(76)63(74)60(46-71)83-69/h24,26,28,30,32,34,36,38,40,42,44,60-69,71-72,74-77H,14-23,25,27,29,31,33,35,37,39,41,43,45-47H2,1-13H3,(H,70,73)(H,78,79)(H,80,81)/b49-26+,50-28+,51-30-,52-32-,53-34-,54-36-,55-38-,56-40-,57-42-,58-44-/t60-,61-,62-,63-,64-,65+,66-,67-,68?,69+/m1/s1
InChIKeyUUCCUHBMBRNBLG-DOEOOMFYSA-N
ChEBI Ontology
Outgoing Relation(s)
β-D-glucosyl-(1→4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate (CHEBI:15696) is a polyprenyl phospho oligosaccharide (CHEBI:26186)
β-D-glucosyl-(1→4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate (CHEBI:15696) is conjugate acid of β-D-glucosyl-(1→4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate(2−) (CHEBI:59985)
Incoming Relation(s)
β-D-glucosyl-(1→4)-N-acetyl-α-D-glucosaminyl undecaprenyl diphosphate (CHEBI:132876) is a β-D-glucosyl-(1→4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate (CHEBI:15696)
β-D-glucosyl-(1→4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate(2−) (CHEBI:59985) is conjugate base of β-D-glucosyl-(1→4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate (CHEBI:15696)
IUPAC Name 
2-(acetylamino)-2-deoxy-4-O-β-D-glucopyranosyl-1-O-{hydroxy[(hydroxy{[(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}phosphoryl)oxy]phosphoryl}-D-glucopyranose
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