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CHEBI:142885 - 4-O-({poly[3-N-acetyl-β-D-glucosaminyl-1-D-ribitylphosphonato]}-di{[2R]-1-glycerylphosphonato})-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphate polyanion

ChEBI IDCHEBI:142885
ChEBI Name4-O-({poly[3-N-acetyl-β-D-glucosaminyl-1-D-ribitylphosphonato]}-di{[2R]-1-glycerylphosphonato})-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphate polyanion
Stars
ASCII Name4-O-({poly[3-N-acetyl-beta-D-glucosaminyl-1-D-ribitylphosphonato]}-di{[2R]-1-glycerylphosphonato})-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphate polyanion
DefinitionA polyanionic polymer obtained by deprotonation of the phosphate and diphosphate groups of 4-O-({poly[3-N-acetyl-β-D-glucosaminyl-1-D-ribitylphosphonato]}-di{[2R]-1-glycerylphosphonato})-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphate; major species at pH 7.3.
SubmitterKristian Axelsen
DownloadsMolfile
Formula(C13H23NO12P)n.C77H128N2O27P4
Net Charge-5
Average Mass2054.050
Monoisotopic Mass2052.86402
SMILESCC(=O)N[C@H]1[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](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](OP(=O)([O-])OC[C@H](O)COP(=O)([O-])OC[C@H](O)COP(=O)([O-])OC[C@@H](O)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3NC(C)=O)[C@@H](O)CO)[C@H](O)[C@H]2NC(C)=O)[C@@H]1O
InChIInChI=1S/C90H156N3O39P5/c1-57(2)26-16-27-58(3)28-17-29-59(4)30-18-31-60(5)32-19-33-61(6)34-20-35-62(7)36-21-37-63(8)38-22-39-64(9)40-23-41-65(10)42-24-43-66(11)44-25-45-67(12)46-47-119-136(115,116)132-137(117,118)131-90-80(93-70(15)100)83(107)86(76(50-96)127-90)129-89-79(92-69(14)99)84(108)87(77(51-97)126-89)130-135(113,114)123-55-72(102)54-121-133(109,110)120-52-71(101)53-122-134(111,112)124-56-74(104)85(73(103)48-94)128-88-78(91-68(13)98)82(106)81(105)75(49-95)125-88/h26,28,30,32,34,36,38,40,42,44,46,71-90,94-97,101-108H,16-25,27,29,31,33,35,37,39,41,43,45,47-56H2,1-15H3,(H,91,98)(H,92,99)(H,93,100)(H,109,110)(H,111,112)(H,113,114)(H,115,116)(H,117,118)/p-5/b58-28+,59-30+,60-32-,61-34-,62-36-,63-38-,64-40-,65-42-,66-44-,67-46-/t71-,72+,73-,74+,75+,76+,77+,78+,79+,80+,81+,82+,83+,84+,85-,86+,87+,88-,89-,90+/m0/s1
InChIKeySBLXUYKMCAWXNX-AJYSVGFSSA-I
ChEBI Ontology
Outgoing Relation(s)
4-O-({poly[3-N-acetyl-β-D-glucosaminyl-1-D-ribitylphosphonato]}-di{[2R]-1-glycerylphosphonato})-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphate polyanion (CHEBI:142885) is a organophosphate oxoanion (CHEBI:58945)
4-O-({poly[3-N-acetyl-β-D-glucosaminyl-1-D-ribitylphosphonato]}-di{[2R]-1-glycerylphosphonato})-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphate polyanion (CHEBI:142885) is a polyanionic polymer (CHEBI:61469)
UniProt Name  Source
4-O-([3-N-acetyl-β-D-glucosaminyl-1-D-ribitylphospho]n-di{[2R]-1-glycerylphospho})-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphateUniProt