CHEBI:111523 - validone 7-phosphate(2−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name validone 7-phosphate(2−)
ChEBI ID CHEBI:111523
ChEBI ASCII Name validone 7-phosphate(2-)
Definition An organophosphate oxoanion obtained by deprotonation of the phosphate OH groups of validone 7-phosphate; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C7H11O8P
Net Charge -2
Average Mass 254.132
Monoisotopic Mass 254.019
InChI InChI=1S/C7H13O8P/c8-4-1-3(2-15-16(12,13)14)5(9)7(11)6(4)10/h3,5-7,9-11H,1-2H2,(H2,12,13,14)/p-2/t3-,5-,6+,7+/m1/s1
InChIKey TWEGOAYSXFKLRS-UMWONPOSSA-L
SMILES [C@H]1([C@H](CC([C@@H]([C@H]1O)O)=O)COP([O-])(=O)[O-])O
ChEBI Ontology
Outgoing validone 7-phosphate(2−) (CHEBI:111523) is a organophosphate oxoanion (CHEBI:58945)
validone 7-phosphate(2−) (CHEBI:111523) is conjugate base of validone 7-phosphate (CHEBI:131949)
Incoming validone 7-phosphate (CHEBI:131949) is conjugate acid of validone 7-phosphate(2−) (CHEBI:111523)
IUPAC Name
[(1R,2R,3S,4R)-2,3,4-trihydroxy-5-oxocyclohexyl]methyl phosphate
Synonym Source
validone 7-phosphate UniProt
Manual Xref Database
CPD-9668 MetaCyc
View more database links
Citation Waiting for Citations Type Source
17335096 PubMed citation SUBMITTER
Last Modified
18 May 2016