CHEBI:30089 - acetate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name acetate
ChEBI ID CHEBI:30089
Definition A monocarboxylic acid anion resulting from the removal of a proton from the carboxy group of acetic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:40480, CHEBI:13704, CHEBI:22165
Supplier Information ChemicalBook:CB21258851, eMolecules:883719
Download Molfile XML SDF
more structures >>
Wikipedia License
An acetate is a salt formed by the combination of acetic acid with a base (e.g. alkaline, earthy, metallic, nonmetallic or radical base). "Acetate" also describes the conjugate base or ion (specifically, the negatively charged ion called an anion) typically found in aqueous solution and written with the chemical formula C2H3O−2. The neutral molecules formed by the combination of the acetate ion and a positive ion (called a cation) are also commonly called "acetates" (hence, acetate of lead, acetate of aluminium, etc.). The simplest of these is hydrogen acetate (called acetic acid) with corresponding salts, esters, and the polyatomic anion CH3CO−2, or CH3COO−. Most of the approximately 5 million tonnes of acetic acid produced annually in industry are used in the production of acetates, which usually take the form of polymers. In nature, acetate is the most common building block for biosynthesis.
Read full article at Wikipedia
Formula C2H3O2
Net Charge -1
Average Mass 59.04402
Monoisotopic Mass 59.01385
InChI InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)/p-1
InChIKey QTBSBXVTEAMEQO-UHFFFAOYSA-M
SMILES CC([O-])=O
Metabolite of Species Details
Saccharomyces cerevisiae (NCBI:txid4932) Source: yeast.sf.net See: PubMed
Homo sapiens (NCBI:txid9606) See: DOI
Roles Classification
Biological Role(s): Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing acetate (CHEBI:30089) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
acetate (CHEBI:30089) has role human metabolite (CHEBI:77746)
acetate (CHEBI:30089) is a monocarboxylic acid anion (CHEBI:35757)
acetate (CHEBI:30089) is conjugate base of acetic acid (CHEBI:15366)
Incoming (2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl)acetate (CHEBI:19733) has functional parent acetate (CHEBI:30089)
(2,6-dihydroxyphenyl)acetate (CHEBI:28440) has functional parent acetate (CHEBI:30089)
(5-oxo-2-sulfonato-2,5-dihydrofuran-2-yl)acetate (CHEBI:20479) has functional parent acetate (CHEBI:30089)
1-palmityl-2-acetyl-sn-glycero-3-phosphate(2−) (CHEBI:78385) has functional parent acetate (CHEBI:30089)
4-chlorophenylacetate (CHEBI:16237) has functional parent acetate (CHEBI:30089)
4-hydroxyphenylacetate (CHEBI:48999) has functional parent acetate (CHEBI:30089)
chloroacetate (CHEBI:23123) has functional parent acetate (CHEBI:30089)
dichloroacetate (CHEBI:28240) has functional parent acetate (CHEBI:30089)
difluoroacetate (CHEBI:23715) has functional parent acetate (CHEBI:30089)
fluoroacetate (CHEBI:18172) has functional parent acetate (CHEBI:30089)
glycolate (CHEBI:29805) has functional parent acetate (CHEBI:30089)
haloacetate(1−) (CHEBI:85638) has functional parent acetate (CHEBI:30089)
homogentisate (CHEBI:16169) has functional parent acetate (CHEBI:30089)
mandelate (CHEBI:25147) has functional parent acetate (CHEBI:30089)
phenylacetate (CHEBI:18401) has functional parent acetate (CHEBI:30089)
trichloroacetate (CHEBI:27455) has functional parent acetate (CHEBI:30089)
trifluoroacetate (CHEBI:27110) has functional parent acetate (CHEBI:30089)
calcium acetate (CHEBI:3310) has part acetate (CHEBI:30089)
ethylammonium acetate (CHEBI:63879) has part acetate (CHEBI:30089)
guanidine acetate (CHEBI:132481) has part acetate (CHEBI:30089)
lead tetraacetate (CHEBI:77245) has part acetate (CHEBI:30089)
lithium acetate (CHEBI:63045) has part acetate (CHEBI:30089)
potassium acetate (CHEBI:32029) has part acetate (CHEBI:30089)
sodium acetate (CHEBI:32954) has part acetate (CHEBI:30089)
acetic acid (CHEBI:15366) is conjugate acid of acetate (CHEBI:30089)
IUPAC Name
acetate
Synonyms Sources
acetate UniProt
ACETATE ION PDBeChem
acetic acid, ion(1−) ChemIDplus
Azetat ChEBI
CH3‒COO IUPAC
Ethanoat ChEBI
ethanoate ChEBI
MeCO2 anion NIST Chemistry WebBook
Manual Xrefs Databases
ACET MetaCyc
Acetate Wikipedia
ACT PDBeChem
C00033 KEGG COMPOUND
c0050 UM-BBD
DB03166 DrugBank
View more database links
Registry Numbers Types Sources
1379 Gmelin Registry Number Gmelin
1901470 Reaxys Registry Number Reaxys
71-50-1 CAS Registry Number NIST Chemistry WebBook
71-50-1 CAS Registry Number ChemIDplus
Citations
Kim YM, Lee SE, Park BS, Son MK, Jung YM, Yang SO, Choi HK, Hur SH, Yum JH (2012)
Proteomic analysis on acetate metabolism in Citrobacter sp. BL-4.
International journal of biological sciences 8, 66-78 [PubMed:22211106]
[show Abstract]
Hosseini M, Ganjali MR, Veismohammadi B, Faridbod F, Abkenar SD, Salavati-Niasari M (2012)
Selective recognition of acetate ion based on fluorescence enhancement chemosensor.
Luminescence : the journal of biological and chemical luminescence 27, 341-345 [PubMed:22371380]
[show Abstract]
Salek RM, Maguire ML, Bentley E, Rubtsov DV, Hough T, Cheeseman M, Nunez D, Sweatman BC, Haselden JN, Cox RD, Connor SC, Griffin JL (2007)
A metabolomic comparison of urinary changes in type 2 diabetes in mouse, rat, and human.
Physiological genomics 29, 99-108 [PubMed:17190852]
[show Abstract]
Last Modified
13 January 2017