Difference between revisions of "CPD-479"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-479 CPD-479] == * smiles: ** CSCCC(C([O-])=O)=O * common name: ** 4-(methylthio)-2-oxobutan...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** CSCCC(C([O-])=O)=O | ** CSCCC(C([O-])=O)=O | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 147.168 | ** 147.168 | ||
| + | * inchi key: | ||
| + | ** InChIKey=SXFSQZDSUWACKX-UHFFFAOYSA-M | ||
| + | * common name: | ||
| + | ** 4-(methylsulfanyl)-2-oxobutanoate | ||
* Synonym(s): | * Synonym(s): | ||
** 2-keto-methyl-thio-butyrate | ** 2-keto-methyl-thio-butyrate | ||
| Line 27: | Line 27: | ||
** 2-oxomethionine | ** 2-oxomethionine | ||
** 2-keto-4-methylthiobutanoate | ** 2-keto-4-methylthiobutanoate | ||
| + | ** 4-(methylthio)-2-oxobutanoate | ||
== Reaction(s) known to consume the compound == | == Reaction(s) known to consume the compound == | ||
| − | |||
== Reaction(s) known to produce the compound == | == Reaction(s) known to produce the compound == | ||
* [[R147-RXN]] | * [[R147-RXN]] | ||
| Line 35: | Line 35: | ||
* [[RXN-14147]] | * [[RXN-14147]] | ||
== External links == | == External links == | ||
| − | * | + | * CHEMSPIDER: |
| + | ** [http://www.chemspider.com/Chemical-Structure.3776616.html 3776616] | ||
* PUBCHEM: | * PUBCHEM: | ||
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=4584184 4584184] | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=4584184 4584184] | ||
| + | * CHEBI: | ||
| + | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16723 16723] | ||
| + | * GO-TERMS : (REFMET "2-Oxo-4-methylthiobutanoic acid" NIL midford 3701443689 NIL NIL) | ||
* HMDB : HMDB01553 | * HMDB : HMDB01553 | ||
* LIGAND-CPD: | * LIGAND-CPD: | ||
** [http://www.genome.jp/dbget-bin/www_bget?C01180 C01180] | ** [http://www.genome.jp/dbget-bin/www_bget?C01180 C01180] | ||
| − | |||
| − | |||
| − | |||
| − | |||
* METABOLIGHTS : MTBLC16723 | * METABOLIGHTS : MTBLC16723 | ||
| + | * BIGG : 2kmb | ||
{{#set: smiles=CSCCC(C([O-])=O)=O}} | {{#set: smiles=CSCCC(C([O-])=O)=O}} | ||
| − | |||
| − | |||
{{#set: molecular weight=147.168 }} | {{#set: molecular weight=147.168 }} | ||
| − | {{#set: common name=2-keto-methyl-thio-butyrate|2-keto-4-methylthiobutyrate|4-methylthio-2-oxobutanoate|α-keto-4-methylthiobutyrate|4-methylthio-2-ketobutyrate|4-methylthio-2-ketobutanoate|4-methylthio-2-oxobutyrate|2-ketomethiobutyrate|KMTB|α-ketomethiobutyrate|2-keto-4-methylthiobutyric acid|α-ketomethiobutyric acid|α-keto-γ-methylthiobutyrate|α-keto-γ-methylthiobutyric acid|2-oxo-4-methylthiobutanoic acid|2-oxomethionine|2-keto-4-methylthiobutanoate | + | {{#set: inchi key=InChIKey=SXFSQZDSUWACKX-UHFFFAOYSA-M}} |
| − | + | {{#set: common name=4-(methylsulfanyl)-2-oxobutanoate}} | |
| + | {{#set: common name=2-keto-methyl-thio-butyrate|2-keto-4-methylthiobutyrate|4-methylthio-2-oxobutanoate|α-keto-4-methylthiobutyrate|4-methylthio-2-ketobutyrate|4-methylthio-2-ketobutanoate|4-methylthio-2-oxobutyrate|2-ketomethiobutyrate|KMTB|α-ketomethiobutyrate|2-keto-4-methylthiobutyric acid|α-ketomethiobutyric acid|α-keto-γ-methylthiobutyrate|α-keto-γ-methylthiobutyric acid|2-oxo-4-methylthiobutanoic acid|2-oxomethionine|2-keto-4-methylthiobutanoate|4-(methylthio)-2-oxobutanoate}} | ||
{{#set: produced by=R147-RXN}} | {{#set: produced by=R147-RXN}} | ||
{{#set: reversible reaction associated=RXN-14147}} | {{#set: reversible reaction associated=RXN-14147}} | ||
Latest revision as of 14:35, 10 January 2019
Contents
Metabolite CPD-479
- smiles:
- CSCCC(C([O-])=O)=O
- molecular weight:
- 147.168
- inchi key:
- InChIKey=SXFSQZDSUWACKX-UHFFFAOYSA-M
- common name:
- 4-(methylsulfanyl)-2-oxobutanoate
- Synonym(s):
- 2-keto-methyl-thio-butyrate
- 2-keto-4-methylthiobutyrate
- 4-methylthio-2-oxobutanoate
- α-keto-4-methylthiobutyrate
- 4-methylthio-2-ketobutyrate
- 4-methylthio-2-ketobutanoate
- 4-methylthio-2-oxobutyrate
- 2-ketomethiobutyrate
- KMTB
- α-ketomethiobutyrate
- 2-keto-4-methylthiobutyric acid
- α-ketomethiobutyric acid
- α-keto-γ-methylthiobutyrate
- α-keto-γ-methylthiobutyric acid
- 2-oxo-4-methylthiobutanoic acid
- 2-oxomethionine
- 2-keto-4-methylthiobutanoate
- 4-(methylthio)-2-oxobutanoate
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- CHEMSPIDER:
- PUBCHEM:
- CHEBI:
- GO-TERMS : (REFMET "2-Oxo-4-methylthiobutanoic acid" NIL midford 3701443689 NIL NIL)
- HMDB : HMDB01553
- LIGAND-CPD:
- METABOLIGHTS : MTBLC16723
- BIGG : 2kmb
"CSCCC(C([O-])=O)=O" cannot be used as a page name in this wiki.
