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CHEBI:65080 - N-acetyl-α-D-glucosaminyl-1-diphospho-trans,polycis-decaprenol(2−)

ChEBI IDCHEBI:65080
ChEBI NameN-acetyl-α-D-glucosaminyl-1-diphospho-trans,polycis-decaprenol(2−)
Stars
ASCII NameN-acetyl-alpha-D-glucosaminyl-1-diphospho-trans,polycis-decaprenol(2-)
DefinitionAn organophosphate oxoanion obtained by deprotonation of the diphosphate OH groups of N-acetyl-α-D-glucosaminyl-1-diphospho-trans,polycis-decaprenol; major species at pH 7.3.
Last Modified2 February 2018
SubmitterKAX
DownloadsMolfile
FormulaC58H95NO12P2
Net Charge-2
Average Mass1060.341
Monoisotopic Mass1059.63405
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)CCC=C(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O
InChIInChI=1S/C58H97NO12P2/c1-43(2)22-13-23-44(3)24-14-25-45(4)26-15-27-46(5)28-16-29-47(6)30-17-31-48(7)32-18-33-49(8)34-19-35-50(9)36-20-37-51(10)38-21-39-52(11)40-41-68-72(64,65)71-73(66,67)70-58-55(59-53(12)61)57(63)56(62)54(42-60)69-58/h22,24,26,28,30,32,34,36,38,40,54-58,60,62-63H,13-21,23,25,27,29,31,33,35,37,39,41-42H2,1-12H3,(H,59,61)(H,64,65)(H,66,67)/p-2/b44-24+,45-26-,46-28-,47-30-,48-32-,49-34-,50-36-,51-38-,52-40-/t54-,55-,56-,57-,58-/m1/s1
InChIKeyQZCSSLRFYDKWIR-BYWHINGUSA-L
ChEBI Ontology
Outgoing Relation(s)
N-acetyl-α-D-glucosaminyl-1-diphospho-trans,polycis-decaprenol(2−) (CHEBI:65080) is a organophosphate oxoanion (CHEBI:58945)
N-acetyl-α-D-glucosaminyl-1-diphospho-trans,polycis-decaprenol(2−) (CHEBI:65080) is conjugate base of N-acetyl-α-D-glucosaminyl-1-diphospho-trans,polycis-decaprenol (CHEBI:65116)
Incoming Relation(s)
N-acetyl-α-D-glucosaminyl-1-diphospho-trans,polycis-decaprenol (CHEBI:65116) is conjugate acid of N-acetyl-α-D-glucosaminyl-1-diphospho-trans,polycis-decaprenol(2−) (CHEBI:65080)
IUPAC Name 
2-acetamido-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaen-1-yl]oxy}phosphinato)oxy]phosphinato}-2-deoxy-α-D-glucopyranose
Synonym  Source
N-acetyl-α-D-glucosaminyl-1-diphospho-trans,octacis-decaprenol(2−)ChEBI
UniProt Name  Source
N-acetyl-α-D-glucosaminyl-1-diphospho-trans,octa-cis-decaprenolUniProt
Citations