CHEBI:17404 - indan-1-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name indan-1-one
ChEBI ID CHEBI:17404
Definition An indanone that consists of 2,3-dihydro-1H-indene substituted by an oxo group at position 1.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:5892, CHEBI:14437, CHEBI:19056
Supplier Information
Download Molfile XML SDF
Formula C9H8O
Net Charge 0
Average Mass 132.15922
Monoisotopic Mass 132.05751
InChI InChI=1S/C9H8O/c10-9-6-5-7-3-1-2-4-8(7)9/h1-4H,5-6H2
InChIKey QNXSIUBBGPHDDE-UHFFFAOYSA-N
SMILES O=C1CCc2ccccc12
ChEBI Ontology
Outgoing indan-1-one (CHEBI:17404) is a indanone (CHEBI:38132)
Incoming 2-formylindan-1-one (CHEBI:27534) has functional parent indan-1-one (CHEBI:17404)
IUPAC Name
2,3-dihydro-1H-inden-1-one
Synonyms Sources
1-Indanone KEGG COMPOUND
α-hydrindone NIST Chemistry WebBook
α-indanone NIST Chemistry WebBook
Hydrindone KEGG COMPOUND
indan-1-one UniProt
indan-1-one NIST Chemistry WebBook
Indanone KEGG COMPOUND
Manual Xrefs Databases
1-INDANONE MetaCyc
C01504 KEGG COMPOUND
c0395 UM-BBD
HMDB0059602 HMDB
View more database links
Registry Numbers Types Sources
142414 Gmelin Registry Number Gmelin
507957 Beilstein Registry Number Beilstein
507957 Reaxys Registry Number Reaxys
83-33-0 CAS Registry Number ChemIDplus
83-33-0 CAS Registry Number NIST Chemistry WebBook
Last Modified
07 July 2017