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iron*
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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:27930 - indan-2-one
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ChEBI Name
indan-2-one
ChEBI ID
CHEBI:27930
Definition
An indanone with an oxo substituent at position 2. It is a metabolite of indane.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:1173, CHEBI:19664
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Formula
C9H8O
Net Charge
0
Average Mass
132.15922
Monoisotopic Mass
132.05751
InChI
InChI=1S/C9H8O/c10-9-5-7-3-1-2-4-8(7)6-9/h1-4H,5-6H2
InChIKey
UMJJFEIKYGFCAT-UHFFFAOYSA-N
SMILES
O=C1Cc2ccccc2C1
Roles Classification
Biological Role
(s):
xenobiotic metabolite
Any metabolite produced by metabolism of a xenobiotic compound.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
indan-2-one (
CHEBI:27930
)
has role
xenobiotic metabolite (
CHEBI:76206
)
indan-2-one (
CHEBI:27930
)
is a
indanone (
CHEBI:38132
)
Incoming
1-formylindan-2-one (
CHEBI:28779
)
has functional parent
indan-2-one (
CHEBI:27930
)
indan-2-one oxime (
CHEBI:34291
)
has functional parent
indan-2-one (
CHEBI:27930
)
IUPAC Name
1,3-dihydro-2
H
-inden-2-one
Synonyms
Sources
2-Indanone
KEGG COMPOUND
β-hydrindone
NIST Chemistry WebBook
Manual Xrefs
Databases
2INDANONE
MetaCyc
c0402
UM-BBD
C07727
KEGG COMPOUND
View more database links
Registry Numbers
Types
Sources
464655
Gmelin Registry Number
Gmelin
615-13-4
CAS Registry Number
NIST Chemistry WebBook
615-13-4
CAS Registry Number
ChemIDplus
636550
Beilstein Registry Number
Beilstein
636550
Reaxys Registry Number
Reaxys
Citations
Types
Sources
2325154
PubMed citation
Europe PMC
7944365
PubMed citation
Europe PMC
Last Modified
13 March 2017