Difference between revisions of "2K-4CH3-PENTANOATE"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=2K-4CH3-PENTANOATE 2K-4CH3-PENTANOATE] == * smiles: ** CC(C)CC(C([O-])=O)=O * inchi key: ** InC...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** CC(C)CC(C([O-])=O)=O | ** CC(C)CC(C([O-])=O)=O | ||
| + | * molecular weight: | ||
| + | ** 129.135 | ||
* inchi key: | * inchi key: | ||
** InChIKey=BKAJNAXTPSGJCU-UHFFFAOYSA-M | ** InChIKey=BKAJNAXTPSGJCU-UHFFFAOYSA-M | ||
* common name: | * common name: | ||
** 4-methyl-2-oxopentanoate | ** 4-methyl-2-oxopentanoate | ||
| − | |||
| − | |||
* Synonym(s): | * Synonym(s): | ||
** 2-keto-4-methyl-pentanoate | ** 2-keto-4-methyl-pentanoate | ||
| Line 28: | Line 28: | ||
* [[BRANCHED-CHAINAMINOTRANSFERLEU-RXN]] | * [[BRANCHED-CHAINAMINOTRANSFERLEU-RXN]] | ||
== External links == | == External links == | ||
| − | |||
* METABOLIGHTS : MTBLC17865 | * METABOLIGHTS : MTBLC17865 | ||
| − | * | + | * BIGG : 4mop |
| − | * | + | * CAS : 816-66-0 |
* HMDB : HMDB00695 | * HMDB : HMDB00695 | ||
| − | |||
| − | |||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.2766269.html 2766269] | ** [http://www.chemspider.com/Chemical-Structure.2766269.html 2766269] | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17865 17865] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17865 17865] | ||
| − | * | + | * LIGAND-CPD: |
| + | ** [http://www.genome.jp/dbget-bin/www_bget?C00233 C00233] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=3527278 3527278] | ||
{{#set: smiles=CC(C)CC(C([O-])=O)=O}} | {{#set: smiles=CC(C)CC(C([O-])=O)=O}} | ||
| + | {{#set: molecular weight=129.135 }} | ||
{{#set: inchi key=InChIKey=BKAJNAXTPSGJCU-UHFFFAOYSA-M}} | {{#set: inchi key=InChIKey=BKAJNAXTPSGJCU-UHFFFAOYSA-M}} | ||
{{#set: common name=4-methyl-2-oxopentanoate}} | {{#set: common name=4-methyl-2-oxopentanoate}} | ||
| − | |||
{{#set: common name=2-keto-4-methyl-pentanoate|2-oxoisocaproate|2-oxo-4-methylpentanoate|α-ketoisocaproate|α-oxoisocaproate|2-ketoisocaproate|ketoleucine|4-methyl-2-oxopentanoic acid}} | {{#set: common name=2-keto-4-methyl-pentanoate|2-oxoisocaproate|2-oxo-4-methylpentanoate|α-ketoisocaproate|α-oxoisocaproate|2-ketoisocaproate|ketoleucine|4-methyl-2-oxopentanoic acid}} | ||
{{#set: consumed by=KETOISOCAPROATE-RXN|2KETO-4METHYL-PENTANOATE-DEHYDROG-RXN|RXN-7692}} | {{#set: consumed by=KETOISOCAPROATE-RXN|2KETO-4METHYL-PENTANOATE-DEHYDROG-RXN|RXN-7692}} | ||
{{#set: produced by=RXN-13158}} | {{#set: produced by=RXN-13158}} | ||
{{#set: reversible reaction associated=BRANCHED-CHAINAMINOTRANSFERLEU-RXN}} | {{#set: reversible reaction associated=BRANCHED-CHAINAMINOTRANSFERLEU-RXN}} | ||
Latest revision as of 18:15, 9 January 2019
Contents
Metabolite 2K-4CH3-PENTANOATE
- smiles:
- CC(C)CC(C([O-])=O)=O
- molecular weight:
- 129.135
- inchi key:
- InChIKey=BKAJNAXTPSGJCU-UHFFFAOYSA-M
- common name:
- 4-methyl-2-oxopentanoate
- Synonym(s):
- 2-keto-4-methyl-pentanoate
- 2-oxoisocaproate
- 2-oxo-4-methylpentanoate
- α-ketoisocaproate
- α-oxoisocaproate
- 2-ketoisocaproate
- ketoleucine
- 4-methyl-2-oxopentanoic acid
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- METABOLIGHTS : MTBLC17865
- BIGG : 4mop
- CAS : 816-66-0
- HMDB : HMDB00695
- CHEMSPIDER:
- CHEBI:
- LIGAND-CPD:
- PUBCHEM:
"CC(C)CC(C([O-])=O)=O" cannot be used as a page name in this wiki.
