CHEBI:64883 - diacetylchitobiose-6'-phosphate(2−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name diacetylchitobiose-6'-phosphate(2−)
ChEBI ID CHEBI:64883
ChEBI ASCII Name diacetylchitobiose-6'-phosphate(2-)
Definition An organophosphate oxoanion obtained by deprotonation of the phosphate OH groups of diacetylchitobiose-6-phosphate; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Eugeni Belda
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C16H27N2O14P
Net Charge -2
Average Mass 502.36430
Monoisotopic Mass 502.12109
InChI InChI=1S/C16H29N2O14P/c1-5(20)17-9-13(24)14(7(3-19)30-15(9)25)32-16-10(18-6(2)21)12(23)11(22)8(31-16)4-29-33(26,27)28/h7-16,19,22-25H,3-4H2,1-2H3,(H,17,20)(H,18,21)(H2,26,27,28)/p-2/t7-,8-,9-,10-,11-,12-,13-,14-,15?,16+/m1/s1
InChIKey KYKNQNQCPWDNAK-CBTAGEKQSA-L
SMILES CC(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](COP([O-])([O-])=O)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)[C@@H]1O
ChEBI Ontology
Outgoing diacetylchitobiose-6'-phosphate(2−) (CHEBI:64883) is a organophosphate oxoanion (CHEBI:58945)
diacetylchitobiose-6'-phosphate(2−) (CHEBI:64883) is conjugate base of diacetylchitobiose-6'-phosphate (CHEBI:64897)
Incoming diacetylchitobiose-6'-phosphate (CHEBI:64897) is conjugate acid of diacetylchitobiose-6'-phosphate(2−) (CHEBI:64883)
IUPAC Name
2-acetamido-2-deoxy-6-O-phosphonato-β-D-glucopyranosyl-(1→4)-2-acetamido-2-deoxy-D-glucopyranose
Synonyms Sources
2-acetamido-4-O-(2-acetamido-2-deoxy-6-O-phosphonato-β-D-glucopyranosyl)-2-deoxy-D-glucopyranose IUPAC
diacetylchitobiose-6'-phosphate UniProt
diacetylchitobiose-6'-phosphate ChEBI
diacetylchitobiose-6-phosphate ChEBI
N,N'-diacetylchitobiose-6-phosphate ChEBI
Manual Xref Database
DIACETYLCHITOBIOSE-6-PHOSPHATE MetaCyc
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Last Modified
15 June 2012