CHEBI:31575 - ethylparaben

ChEBI IDCHEBI:31575
ChEBI Nameethylparaben
Stars
DefinitionAn ethyl ester resulting from the formal condensation of the carboxy group of 4-hydroxybenzoic acid with ethanol,
Secondary ChEBI IDCHEBI:86616
Last Modified22 February 2017
DownloadsMolfile
FormulaC9H10O3
Net Charge0
Average Mass166.176
Monoisotopic Mass166.06299
SMILESCCOC(=O)c1ccc(O)cc1
InChIInChI=1S/C9H10O3/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6,10H,2H2,1H3
InChIKeyNUVBSKCKDOMJSU-UHFFFAOYSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Aeschynanthus bracteatus (ncbitaxon:175969) - PubMed (18590922)
Roles Classification
Chemical Role:
antimicrobial food preservative  A food preservative which prevents decomposition of food by preventing the growth of fungi or bacteria. In European countries, E-numbers for permitted food preservatives are from E200 to E299, divided into sorbates (E200-209), benzoates (E210-219), sulfites (E220-229), phenols and formates (E230-239), nitrates (E240-259), acetates (E260-269), lactates (E270-279), propionates (E280-289) and others (E290-299).
Biological Roles:
antimicrobial food preservative  A food preservative which prevents decomposition of food by preventing the growth of fungi or bacteria. In European countries, E-numbers for permitted food preservatives are from E200 to E299, divided into sorbates (E200-209), benzoates (E210-219), sulfites (E220-229), phenols and formates (E230-239), nitrates (E240-259), acetates (E260-269), lactates (E270-279), propionates (E280-289) and others (E290-299).
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
antifungal agent  An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
phytoestrogen  Any compound produced by a plant that happens to have estrogenic activity.
Application:
antimicrobial food preservative  A food preservative which prevents decomposition of food by preventing the growth of fungi or bacteria. In European countries, E-numbers for permitted food preservatives are from E200 to E299, divided into sorbates (E200-209), benzoates (E210-219), sulfites (E220-229), phenols and formates (E230-239), nitrates (E240-259), acetates (E260-269), lactates (E270-279), propionates (E280-289) and others (E290-299).
ChEBI Ontology
Outgoing Relation(s)
ethylparaben (CHEBI:31575) has role antifungal agent (CHEBI:35718)
ethylparaben (CHEBI:31575) has role antimicrobial food preservative (CHEBI:65256)
ethylparaben (CHEBI:31575) has role phytoestrogen (CHEBI:76989)
ethylparaben (CHEBI:31575) has role plant metabolite (CHEBI:76924)
ethylparaben (CHEBI:31575) is a 4-hydroxybenzoate ester (CHEBI:79323)
ethylparaben (CHEBI:31575) is a ethyl ester (CHEBI:23990)
ethylparaben (CHEBI:31575) is a organic molecular entity (CHEBI:50860)
ethylparaben (CHEBI:31575) is a paraben (CHEBI:85122)
IUPAC Name 
ethyl 4-hydroxybenzoate
Synonyms  Source
4-hydroxybenzoic acid ethyl esterChemIDplus
Aseptoform eChEMBL
E-214ChEBI
E214ChEBI
p-hydroxybenzoic acid ethyl esterChemIDplus
p-OxybenzoesaeureaethylesterChemIDplus
Manual XrefsDatabases
4773DrugCentral
C00033837KNApSAcK
D01647KEGG DRUG
E4BPDBeChem
EthylparabenWikipedia
HMDB0032573HMDB
Registry NumbersSources
Reaxys:1101972Reaxys
CAS:120-47-8KEGG DRUG
CAS:120-47-8ChemIDplus
CAS:120-47-8NIST Chemistry WebBook
Citations