Benzaldehyde (CHEBI:17169) - EMBL-EBI

ChEBI > Main

CHEBI:17169 - benzaldehyde

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name benzaldehyde
ChEBI ID CHEBI:17169
Definition An arenecarbaldehyde that consists of benzene bearing a single formyl substituent; the simplest aromatic aldehyde and parent of the class of benzaldehydes.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:3019, CHEBI:13875, CHEBI:22697
Supplier Information
Download Molfile XML SDF
  • Find compounds which contain this structure
  • Find compounds which resemble this structure
  • Take structure to the Advanced Search
more structures >>
Save molfile Molfile
Wikipedia License
Waiting for wikipedia content
Read full article at Wikipedia
Formula C7H6O
Net Charge 0
Average Mass 106.12190
Monoisotopic Mass 106.04186
InChI InChI=1S/C7H6O/c8-6-7-4-2-1-3-5-7/h1-6H
InChIKey HUMNYLRZRPPJDN-UHFFFAOYSA-N
SMILES O=Cc1ccccc1
Roles Classification
Biological Role(s): EC 3.5.5.1 (nitrilase) inhibitor An EC 3.5.5.* (hydrolase acting on C-N bonds in nitriles) inhibitor that interferes with the action of nitrilase (EC 3.5.5.1). EC 3.1.1.3 (triacylglycerol lipase) inhibitor Any EC 3.1.1.* (carboxylic ester hydrolase) inhibitor that inhibits the action of triacylglycerol lipase (EC 3.1.1.3). plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. flavouring agent A food additive that is used to added improve the taste or odour of a food. odorant receptor agonist An agonist that selectively binds to and activates an odorant receptor.
Application(s): flavouring agent A food additive that is used to added improve the taste or odour of a food. fragrance A substance, extract, or preparation for diffusing or imparting an agreeable or attractive smell.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing benzaldehyde (CHEBI:17169) has role EC 3.1.1.3 (triacylglycerol lipase) inhibitor (CHEBI:65001) benzaldehyde (CHEBI:17169) has role EC 3.5.5.1 (nitrilase) inhibitor (CHEBI:77118) benzaldehyde (CHEBI:17169) has role flavouring agent (CHEBI:35617) benzaldehyde (CHEBI:17169) has role fragrance (CHEBI:48318) benzaldehyde (CHEBI:17169) has role odorant receptor agonist (CHEBI:62873) benzaldehyde (CHEBI:17169) has role plant metabolite (CHEBI:76924) benzaldehyde (CHEBI:17169) is a benzaldehydes (CHEBI:22698)
IUPAC Name
benzaldehyde
Synonyms Sources
Artificial almond oil ChemIDplus
Benzaldehyde KEGG COMPOUND
benzaldehyde UniProt
Benzanoaldehyde HMDB
Benzene carbaldehyde ChemIDplus
Benzene carboxaldehyde ChemIDplus
Benzenecarbonal ChemIDplus
Benzenecarboxaldehyde ChemIDplus
Benzenemethylal ChemIDplus
Benzoic acid aldehyde HMDB
Benzoic aldehyde KEGG COMPOUND
Benzoic aldehyde ChemIDplus
Benzylaldehyde NIST Chemistry WebBook
Ethereal oil of bitter almonds HMDB
Phenylformaldehyde HMDB
Phenylmethanal ChemIDplus
Synthetic oil of bitter almond ChemIDplus
Manual Xrefs Databases
Benzaldehyde Wikipedia
BENZALDEHYDE MetaCyc
C00193 KEGG COMPOUND
C00261 KEGG COMPOUND
c0279 UM-BBD
D02314 KEGG DRUG
HBX PDBeChem
HMDB0006115 HMDB
View more database links
Registry Numbers Types Sources
100-52-7 CAS Registry Number KEGG COMPOUND
100-52-7 CAS Registry Number ChemIDplus
100-52-7 CAS Registry Number NIST Chemistry WebBook
471223 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
11943806 PubMed citation Europe PMC
12692643 PubMed citation Europe PMC
12738275 PubMed citation Europe PMC
12746108 PubMed citation Europe PMC
1388821 PubMed citation Europe PMC
15087594 PubMed citation Europe PMC
15658857 PubMed citation Europe PMC
16248550 PubMed citation Europe PMC
16508147 PubMed citation Europe PMC
16557466 PubMed citation Europe PMC
18348134 PubMed citation Europe PMC
20733068 PubMed citation Europe PMC
20878540 PubMed citation Europe PMC
21035797 PubMed citation Europe PMC
21538605 PubMed citation Europe PMC
21773601 PubMed citation Europe PMC
21828928 PubMed citation Europe PMC
23263855 PubMed citation Europe PMC
Last Modified
05 August 2016
General Comment
2014-01-27 For inhibition of triacylglycerol lipase by benzaldehyde, see Xiong, J., Wu, J., Xu, G. and Yang, L., Chem. Eng. J., 2008, v138, pp 258-263.

ChEBI is part of the ELIXIR infrastructure

This service is an Elixir Core Data Resource. Read more ... EMBL European Bioinformatics Institute
  • News
  • Our impact
  • Contact us
  • Intranet

Services

  • By topic
  • By name (A-Z)
  • Help & Support
  • Long-term data preservation

Research

  • Overview
  • Publications
  • Research groups
  • Postdocs & PhDs

Training

  • Overview
  • Train at EBI
  • Train outside EBI
  • Train online
  • Contact organisers

Industry

  • Overview
  • Members Area
  • Workshops
  • SME Forum
  • Contact Industry programme

About us

  • Overview
  • Leadership
  • Funding
  • Background
  • Collaboration
  • Jobs
  • People & groups
  • News
  • Events
  • Visit us
  • Contact us

EMBL-EBI, Wellcome Genome Campus, Hinxton, Cambridgeshire, CB10 1SD, UK +44 (0)1223 49 44 44

Copyright © EMBL-EBI 2018 | EBI is an outstation of the European Molecular Biology Laboratory | Terms of use

Từ khóa » C6h5cho Iupac Name