CHEBI:71315 - N'-monoacetylchitobiose-6'-phosphate(1−)

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ChEBI Name N'-monoacetylchitobiose-6'-phosphate(1−)
ChEBI ID CHEBI:71315
ChEBI ASCII Name N'-monoacetylchitobiose-6'-phosphate(1-)
Definition An organophosphate oxoanion that is the conjugate base of N-monoacetylchitobiose-6-phosphate, obtained by deprotonation of the phosphate OH groups and protonation of the free amino group; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Eugeni Belda
Supplier Information
Download Molfile XML SDF
Formula C14H26N2O13P
Net Charge -1
Average Mass 461.33560
Monoisotopic Mass 461.11780
InChI InChI=1S/C14H27N2O13P/c1-4(18)16-8-11(21)9(19)6(3-26-30(23,24)25)28-14(8)29-12-5(2-17)27-13(22)7(15)10(12)20/h5-14,17,19-22H,2-3,15H2,1H3,(H,16,18)(H2,23,24,25)/p-1/t5-,6-,7-,8-,9-,10-,11-,12-,13?,14+/m1/s1
InChIKey YSOAJKLNVFWXBW-UEVOBBHASA-M
SMILES CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](COP([O-])([O-])=O)O[C@H]1O[C@H]1[C@H](O)[C@@H]([NH3+])C(O)O[C@@H]1CO
ChEBI Ontology
Outgoing N'-monoacetylchitobiose-6'-phosphate(1−) (CHEBI:71315) is a organophosphate oxoanion (CHEBI:58945)
N'-monoacetylchitobiose-6'-phosphate(1−) (CHEBI:71315) is conjugate base of N'-monoacetylchitobiose-6'-phosphate (CHEBI:71317)
Incoming N'-monoacetylchitobiose-6'-phosphate (CHEBI:71317) is conjugate acid of N'-monoacetylchitobiose-6'-phosphate(1−) (CHEBI:71315)
IUPAC Name
2-acetamido-2-deoxy-6-O-phosphonato-β-D-glucopyranosyl-(1→4)-2-azaniumyl-2-deoxy-D-glucopyranose
Synonyms Sources
4-O-(2-acetamido-2-deoxy-6-O-phosphonato-β-D-glucopyranosyl)-2-azaniumyl-2-deoxy-D-glucopyranose IUPAC
N'-monoacetylchitobiose-6'-phosphate UniProt
N-monoacetylchitobiose-6-phosphate MetaCyc
N-monoacetylchitobiose-6-phosphate(1−) ChEBI
Manual Xref Database
CPD0-2501 MetaCyc
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Last Modified
24 November 2014