Difference between revisions of "CPD-4127"
From metabolic_network
(Created page with "Category:Gene == Gene Tiso_gene_6998 == * Synonym(s): == Reactions associated == * TRANS-RXN-101 ** pantograph-creinhardtii ** pantograph-creinhardtii...") |
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3-KETOBUTYRATE 3-KETOBUTYRATE] == * smiles: ** CC(=O)CC([O-])=O * inchi key: ** InChIKey=WDJHAL...") |
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| − | [[Category: | + | [[Category:Metabolite]] |
| − | == | + | == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3-KETOBUTYRATE 3-KETOBUTYRATE] == |
| + | * smiles: | ||
| + | ** CC(=O)CC([O-])=O | ||
| + | * inchi key: | ||
| + | ** InChIKey=WDJHALXBUFZDSR-UHFFFAOYSA-M | ||
| + | * common name: | ||
| + | ** acetoacetate | ||
| + | * molecular weight: | ||
| + | ** 101.082 | ||
* Synonym(s): | * Synonym(s): | ||
| + | ** 3-ketobutyrate | ||
| + | ** 3-oxobutanate | ||
| + | ** oxobutyrate | ||
| + | ** acetoacetic acid | ||
| + | ** 3-oxobutyric acid | ||
| + | ** 3-oxobutanoic acid | ||
| + | ** diacetic acid | ||
| + | ** β-ketobutyric acid | ||
| − | == | + | == Reaction(s) known to consume the compound == |
| − | * [[ | + | * [[ACETOACETATE-DECARBOXYLASE-RXN]] |
| − | + | == Reaction(s) known to produce the compound == | |
| − | + | * [[FAA]] | |
| − | == | + | * [[FUMARYLACETOACETASE-RXN]] |
| + | * [[HYDROXYMETHYLGLUTARYL-COA-LYASE-RXN]] | ||
| + | == Reaction(s) of unknown directionality == | ||
| + | * [[RXNI-2]] | ||
| + | * [[HBNOm]] | ||
| + | * [[3-HYDROXYBUTYRATE-DEHYDROGENASE-RXN]] | ||
== External links == | == External links == | ||
| − | {{#set: reaction associated= | + | * UM-BBD-CPD : c0069 |
| + | * CAS : 541-50-4 | ||
| + | * METABOLIGHTS : MTBLC13705 | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6971017 6971017] | ||
| + | * HMDB : HMDB00060 | ||
| + | * LIGAND-CPD: | ||
| + | ** [http://www.genome.jp/dbget-bin/www_bget?C00164 C00164] | ||
| + | * CHEMSPIDER: | ||
| + | ** [http://www.chemspider.com/Chemical-Structure.5341896.html 5341896] | ||
| + | * CHEBI: | ||
| + | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=13705 13705] | ||
| + | * BIGG : acac | ||
| + | {{#set: smiles=CC(=O)CC([O-])=O}} | ||
| + | {{#set: inchi key=InChIKey=WDJHALXBUFZDSR-UHFFFAOYSA-M}} | ||
| + | {{#set: common name=acetoacetate}} | ||
| + | {{#set: molecular weight=101.082 }} | ||
| + | {{#set: common name=3-ketobutyrate|3-oxobutanate|oxobutyrate|acetoacetic acid|3-oxobutyric acid|3-oxobutanoic acid|diacetic acid|β-ketobutyric acid}} | ||
| + | {{#set: consumed by=ACETOACETATE-DECARBOXYLASE-RXN}} | ||
| + | {{#set: produced by=FAA|FUMARYLACETOACETASE-RXN|HYDROXYMETHYLGLUTARYL-COA-LYASE-RXN}} | ||
| + | {{#set: reversible reaction associated=RXNI-2|HBNOm|3-HYDROXYBUTYRATE-DEHYDROGENASE-RXN}} | ||
Revision as of 18:48, 18 March 2018
Contents
Metabolite 3-KETOBUTYRATE
- smiles:
- CC(=O)CC([O-])=O
- inchi key:
- InChIKey=WDJHALXBUFZDSR-UHFFFAOYSA-M
- common name:
- acetoacetate
- molecular weight:
- 101.082
- Synonym(s):
- 3-ketobutyrate
- 3-oxobutanate
- oxobutyrate
- acetoacetic acid
- 3-oxobutyric acid
- 3-oxobutanoic acid
- diacetic acid
- β-ketobutyric acid
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- UM-BBD-CPD : c0069
- CAS : 541-50-4
- METABOLIGHTS : MTBLC13705
- PUBCHEM:
- HMDB : HMDB00060
- LIGAND-CPD:
- CHEMSPIDER:
- CHEBI:
- BIGG : acac
"CC(=O)CC([O-])=O" cannot be used as a page name in this wiki.
