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InChI=1S/CH4O/c1-2/h2H,1H3
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caffeine
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> Main
CHEBI:86374 - ninhydrin
Main
ChEBI Ontology
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ChEBI Name
ninhydrin
ChEBI ID
CHEBI:86374
Definition
A member of the class of indanones that is indane-1,3-dione bearing two additional hydroxy substituents at position 2.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C9H6O4
Net Charge
0
Average Mass
178.14150
Monoisotopic Mass
178.02661
InChI
InChI=1S/C9H6O4/c10-7-5-3-1-2-4-6(5)8(11)9(7,12)13/h1-4,12-13H
InChIKey
FEMOMIGRRWSMCU-UHFFFAOYSA-N
SMILES
OC1(O)C(=O)c2ccccc2C1=O
Metabolite of Species
Details
Homo sapiens
(NCBI:txid9606)
See:
PubMed
Roles Classification
Biological Role
(s):
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (
Homo sapiens
).
Application
(s):
colour indicator
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
ninhydrin (
CHEBI:86374
)
has role
colour indicator (
CHEBI:50410
)
ninhydrin (
CHEBI:86374
)
has role
human metabolite (
CHEBI:77746
)
ninhydrin (
CHEBI:86374
)
is a
β-diketone (
CHEBI:67265
)
ninhydrin (
CHEBI:86374
)
is a
aromatic ketone (
CHEBI:76224
)
ninhydrin (
CHEBI:86374
)
is a
indanones (
CHEBI:24789
)
ninhydrin (
CHEBI:86374
)
is a
ketone hydrate (
CHEBI:63734
)
IUPAC Name
2,2-dihydroxy-1
H
-indene-1,3(2
H
)-dione
Synonyms
Sources
1,2,3-Indantrione monohydrate
ChemIDplus
1,2,3-Indantrione, 2-hydrate
ChemIDplus
2,2-Dihydroxy-1,3-indandione
ChemIDplus
2,2-Dihydroxyindane-1,3-dione
MetaCyc
Triketohydrindene hydrate
ChemIDplus
Manual Xrefs
Databases
CPD-9188
MetaCyc
Ninhydrin
Wikipedia
View more database links
Registry Numbers
Types
Sources
1910963
Reaxys Registry Number
Reaxys
485-47-2
CAS Registry Number
ChemIDplus
Citations
Types
Sources
25023609
PubMed citation
Europe PMC
25577078
PubMed citation
Europe PMC
25766739
PubMed citation
Europe PMC
25987134
PubMed citation
Europe PMC
26074166
PubMed citation
Europe PMC
Last Modified
08 July 2015