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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
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CHEBI:57676 - questin-2-olate
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ChEBI Ontology
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ChEBI Name
questin-2-olate
ChEBI ID
CHEBI:57676
Definition
The conjugate base of questin arising from selective deprotonation of the 2-hydroxy group.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C16H11O5
Net Charge
-1
Average Mass
283.25550
Monoisotopic Mass
283.06120
InChI
InChI=1S/C16H12O5/c1-
7-
3-
9-
13(11(18)
4-
7)
16(20)
14-
10(15(9)
19)
5-
8(17)
6-
12(14)
21-
2/h3-
6,17-
18H,1-
2H3/p-
1
InChIKey
UUNPIWCQMVNINR-UHFFFAOYSA-M
SMILES
COc1cc([O-])cc2C(=O)c3cc(C)cc(O)c3C(=O)c12
ChEBI Ontology
Outgoing
questin-2-olate (
CHEBI:57676
)
is a
organic anion (
CHEBI:25696
)
questin-2-olate (
CHEBI:57676
)
is conjugate base of
questin (
CHEBI:16200
)
Incoming
questin (
CHEBI:16200
)
is conjugate acid of
questin-2-olate (
CHEBI:57676
)
IUPAC Name
5-hydroxy-4-methoxy-7-methyl-9,10-dioxo-9,10-dihydroanthracen-2-olate
Synonym
Source
questin
UniProt
Last Modified
13 December 2012