EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:62602 - 2-O-[α-D-mannopyranosyl-(1→2)-α-D-glucopyranosyl]-3-O-phosphonato-D-glycerate(3−)

ChEBI IDCHEBI:62602
ChEBI Name2-O-[α-D-mannopyranosyl-(1→2)-α-D-glucopyranosyl]-3-O-phosphonato-D-glycerate(3−)
Stars
ASCII Name2-O-[alpha-D-mannopyranosyl-(1->2)-alpha-D-glucopyranosyl]-3-O-phosphonato-D-glycerate(3-)
DefinitionAn organophosphate oxoanion obtained by removal of a total of three protons from the carboxy and phosphate groups of 2-O-[α-D-mannopyranosyl-(1→2)-α-D-glucopyranosyl]-3-O-phospho-D-glyceric acid; major species at pH 7.3.
Last Modified11 July 2019
SubmitterSteve
DownloadsMolfile
FormulaC15H24O17P
Net Charge-3
Average Mass507.314
Monoisotopic Mass507.07676
SMILESO=C([O-])[C@@H](COP(=O)([O-])[O-])O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O
InChIInChI=1S/C15H27O17P/c16-1-4-7(18)9(20)11(22)14(29-4)32-12-10(21)8(19)5(2-17)30-15(12)31-6(13(23)24)3-28-33(25,26)27/h4-12,14-22H,1-3H2,(H,23,24)(H2,25,26,27)/p-3/t4-,5-,6-,7-,8-,9+,10+,11+,12-,14-,15-/m1/s1
InChIKeyJGKAZLJSKYSZED-MQZSKFSESA-K
ChEBI Ontology
Outgoing Relation(s)
2-O-[α-D-mannopyranosyl-(1→2)-α-D-glucopyranosyl]-3-O-phosphonato-D-glycerate(3−) (CHEBI:62602) is a carbohydrate acid derivative anion (CHEBI:63551)
2-O-[α-D-mannopyranosyl-(1→2)-α-D-glucopyranosyl]-3-O-phosphonato-D-glycerate(3−) (CHEBI:62602) is a monocarboxylic acid anion (CHEBI:35757)
2-O-[α-D-mannopyranosyl-(1→2)-α-D-glucopyranosyl]-3-O-phosphonato-D-glycerate(3−) (CHEBI:62602) is a organophosphate oxoanion (CHEBI:58945)
2-O-[α-D-mannopyranosyl-(1→2)-α-D-glucopyranosyl]-3-O-phosphonato-D-glycerate(3−) (CHEBI:62602) is conjugate base of 2-O-[α-D-mannopyranosyl-(1→2)-α-D-glucopyranosyl]-3-O-phospho-D-glyceric acid (CHEBI:62603)
Incoming Relation(s)
2-O-[α-D-mannopyranosyl-(1→2)-α-D-glucopyranosyl]-3-O-phospho-D-glyceric acid (CHEBI:62603) is conjugate acid of 2-O-[α-D-mannopyranosyl-(1→2)-α-D-glucopyranosyl]-3-O-phosphonato-D-glycerate(3−) (CHEBI:62602)
IUPAC Name 
(2R)-2-{[2-O-(α-D-mannopyranosyl)-α-D-glucopyranosyl]oxy}-3-(phosphonatooxy)propanoate
Synonyms  Source
2-O-[α-D-mannosyl-(1→2)-α-D-glucosyl]-3-O-phosphonato-D-glycerate(3−)ChEBI
2-O-[2-O-(α-D-mannopyranosyl)-α-D-glucopyranosyl]-3-O-phosphonato-D-glycerateChEBI
2-O-[α-D-mannopyranosyl-(1→2)-α-D-glucopyranosyl]-3-O-phosphonato-D-glycerateChEBI
2-O-[α-D-mannosyl-(1→2)-α-D-glucosyl]-3-O-phosphonato-D-glycerateChEBI
2-O-[2-O-(α-D-mannopyranosyl)-α-D-glucopyranosyl]-3-O-phosphonato-D-glycerate(3−)ChEBI
2-O-[2-O-(α-D-mannopyranosyl)-α-D-glucopyranosyl]-3-phospho-D-glycerateChEBI
UniProt Name  Source
(2R)-2-O-[α-D-mannopyranosyl-(1→2)-α-D-glucopyranosyl]-3-phospho-glycerateUniProt
Citations