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CHEBI:111523 - validone 7-phosphate(2−)
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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
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Formula
C7H11O8P
Net Charge
-2
Average Mass
254.132
Monoisotopic Mass
254.02025
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
[(1
R
,2
R
,3
S
,4
R
)-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
Type
Source
17335096
PubMed citation
SUBMITTER
Last Modified
18 May 2016