Difference between revisions of "CPD-231"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-231 CPD-231] == * smiles: ** CC(C)(O)C(=O)C(=O)[O-] * common name: ** 3-hydroxy-3-methyl-2-...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** CC(C)(O)C(=O)C(=O)[O-] | ** CC(C)(O)C(=O)C(=O)[O-] | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 131.108 | ** 131.108 | ||
| + | * inchi key: | ||
| + | ** InChIKey=DNOPJXBPONYBLB-UHFFFAOYSA-M | ||
| + | * common name: | ||
| + | ** 3-hydroxy-3-methyl-2-oxobutanoate | ||
* Synonym(s): | * Synonym(s): | ||
** 2-oxo-3-hydroxyisovalerate | ** 2-oxo-3-hydroxyisovalerate | ||
| Line 17: | Line 17: | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
== External links == | == External links == | ||
| − | |||
| − | |||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.4925367.html 4925367] | ** [http://www.chemspider.com/Chemical-Structure.4925367.html 4925367] | ||
| Line 25: | Line 23: | ||
* LIGAND-CPD: | * LIGAND-CPD: | ||
** [http://www.genome.jp/dbget-bin/www_bget?C04181 C04181] | ** [http://www.genome.jp/dbget-bin/www_bget?C04181 C04181] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6419735 6419735] | ||
{{#set: smiles=CC(C)(O)C(=O)C(=O)[O-]}} | {{#set: smiles=CC(C)(O)C(=O)C(=O)[O-]}} | ||
| − | |||
| − | |||
{{#set: molecular weight=131.108 }} | {{#set: molecular weight=131.108 }} | ||
| + | {{#set: inchi key=InChIKey=DNOPJXBPONYBLB-UHFFFAOYSA-M}} | ||
| + | {{#set: common name=3-hydroxy-3-methyl-2-oxobutanoate}} | ||
{{#set: common name=2-oxo-3-hydroxyisovalerate}} | {{#set: common name=2-oxo-3-hydroxyisovalerate}} | ||
{{#set: consumed by=KARI_LPAREN_23dhmb_RPAREN_}} | {{#set: consumed by=KARI_LPAREN_23dhmb_RPAREN_}} | ||
Latest revision as of 14:42, 10 January 2019
Contents
Metabolite CPD-231
- smiles:
- CC(C)(O)C(=O)C(=O)[O-]
- molecular weight:
- 131.108
- inchi key:
- InChIKey=DNOPJXBPONYBLB-UHFFFAOYSA-M
- common name:
- 3-hydroxy-3-methyl-2-oxobutanoate
- Synonym(s):
- 2-oxo-3-hydroxyisovalerate
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
"CC(C)(O)C(=O)C(=O)[O-" cannot be used as a page name in this wiki.
