CHEBI:58312 - 6-phosphonato-β-D-glucosyl-(1→4)-D-glucose(2−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 6-phosphonato-β-D-glucosyl-(1→4)-D-glucose(2−)
ChEBI ID CHEBI:58312
ChEBI ASCII Name 6-phosphonato-beta-D-glucosyl-(1->4)-D-glucose(2-)
Definition An organophosphate oxoanion arising from deprotonation of the phosphate OH groups of 6-phospho-β-D-glucosyl-(1→4)-D-glucose; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C12H21O14P
Net Charge -2
Average Mass 420.26050
Monoisotopic Mass 420.06799
InChI InChI=1S/C12H23O14P/c13-1-3-10(7(16)8(17)11(19)24-3)26-12-9(18)6(15)5(14)4(25-12)2-23-27(20,21)22/h3-19H,1-2H2,(H2,20,21,22)/p-2/t3-,4-,5-,6+,7-,8-,9-,10-,11?,12+/m1/s1
InChIKey ITPHOIFCAFNCLL-CUHNMECISA-L
SMILES OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O[C@@H]1O[C@H](COP([O-])([O-])=O)[C@@H](O)[C@H](O)[C@H]1O
ChEBI Ontology
Outgoing 6-phosphonato-β-D-glucosyl-(1→4)-D-glucose(2−) (CHEBI:58312) is a organophosphate oxoanion (CHEBI:58945)
6-phosphonato-β-D-glucosyl-(1→4)-D-glucose(2−) (CHEBI:58312) is conjugate base of 6-phospho-β-D-glucosyl-(1→4)-D-glucose (CHEBI:17888)
Incoming 6-phospho-β-D-glucosyl-(1→4)-D-glucose (CHEBI:17888) is conjugate acid of 6-phosphonato-β-D-glucosyl-(1→4)-D-glucose(2−) (CHEBI:58312)
IUPAC Name
6-O-phosphonato-β-D-glucopyranosyl-(1→4)-D-glucopyranose
Synonyms Sources
4-O-(6-O-phosphonato-β-D-glucopyranosyl)-D-glucopyranose IUPAC
6'-O-phosphonatocellobiose ChEBI
6'-O-phosphonatocellobiose dianion ChEBI
6'-O-phosphonatocellobiose(2−) ChEBI
6'-phosphonatocellobiose ChEBI
6'-phosphonatocellobiose dianion ChEBI
6'-phosphonatocellobiose(2−) ChEBI
6-phospho-β-D-glucosyl-(1→4)-D-glucose UniProt
6-phosphonato-β-D-glucosyl-(1→4)-D-glucose ChEBI
6-phosphonato-β-D-glucosyl-(1→4)-D-glucose dianion ChEBI
Last Modified
24 November 2014