Difference between revisions of "CPD-10353"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-10353 CPD-10353] == * smiles: ** CC(O)C(=O)C * common name: ** (R)-acetoin * inchi key: **...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** CC(O)C(=O)C | ** CC(O)C(=O)C | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 88.106 | ** 88.106 | ||
| + | * inchi key: | ||
| + | ** InChIKey=ROWKJAVDOGWPAT-GSVOUGTGSA-N | ||
| + | * common name: | ||
| + | ** (R)-acetoin | ||
* Synonym(s): | * Synonym(s): | ||
** (R)-2-acetoin | ** (R)-2-acetoin | ||
| Line 25: | Line 25: | ||
* [[RR-BUTANEDIOL-DEHYDROGENASE-RXN]] | * [[RR-BUTANEDIOL-DEHYDROGENASE-RXN]] | ||
== External links == | == External links == | ||
| − | |||
| − | |||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.388445.html 388445] | ** [http://www.chemspider.com/Chemical-Structure.388445.html 388445] | ||
| Line 33: | Line 31: | ||
* LIGAND-CPD: | * LIGAND-CPD: | ||
** [http://www.genome.jp/dbget-bin/www_bget?C00810 C00810] | ** [http://www.genome.jp/dbget-bin/www_bget?C00810 C00810] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=439314 439314] | ||
{{#set: smiles=CC(O)C(=O)C}} | {{#set: smiles=CC(O)C(=O)C}} | ||
| − | |||
| − | |||
{{#set: molecular weight=88.106 }} | {{#set: molecular weight=88.106 }} | ||
| + | {{#set: inchi key=InChIKey=ROWKJAVDOGWPAT-GSVOUGTGSA-N}} | ||
| + | {{#set: common name=(R)-acetoin}} | ||
{{#set: common name=(R)-2-acetoin|(R)-3-hydroxy-2-butanone|(R)-3-hydroxybutan-2-one|(R)-dimethylketol|(3R)-3-hydroxybutan-2-one|(-)-acetoin|D-(-)-acetoin|levorotatory acetoin|(R)-acetylmethylcarbinol}} | {{#set: common name=(R)-2-acetoin|(R)-3-hydroxy-2-butanone|(R)-3-hydroxybutan-2-one|(R)-dimethylketol|(3R)-3-hydroxybutan-2-one|(-)-acetoin|D-(-)-acetoin|levorotatory acetoin|(R)-acetylmethylcarbinol}} | ||
{{#set: reversible reaction associated=RR-BUTANEDIOL-DEHYDROGENASE-RXN}} | {{#set: reversible reaction associated=RR-BUTANEDIOL-DEHYDROGENASE-RXN}} | ||
Latest revision as of 12:02, 10 January 2019
Contents
Metabolite CPD-10353
- smiles:
- CC(O)C(=O)C
- molecular weight:
- 88.106
- inchi key:
- InChIKey=ROWKJAVDOGWPAT-GSVOUGTGSA-N
- common name:
- (R)-acetoin
- Synonym(s):
- (R)-2-acetoin
- (R)-3-hydroxy-2-butanone
- (R)-3-hydroxybutan-2-one
- (R)-dimethylketol
- (3R)-3-hydroxybutan-2-one
- (-)-acetoin
- D-(-)-acetoin
- levorotatory acetoin
- (R)-acetylmethylcarbinol
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
