Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
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-1
H
-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
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
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-1
H
-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