Difference between revisions of "ACETONE"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ACETONE ACETONE] == * smiles: ** CC(=O)C * common name: ** acetone * inchi key: ** InChIKey=CSC...") |
|||
| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** CC(=O)C | ** CC(=O)C | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 58.08 | ** 58.08 | ||
| + | * inchi key: | ||
| + | ** InChIKey=CSCPPACGZOOCGX-UHFFFAOYSA-N | ||
| + | * common name: | ||
| + | ** acetone | ||
* Synonym(s): | * Synonym(s): | ||
** dimethylketone | ** dimethylketone | ||
| Line 17: | Line 17: | ||
* [[RXN-8630]] | * [[RXN-8630]] | ||
== Reaction(s) known to produce the compound == | == Reaction(s) known to produce the compound == | ||
| − | |||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
== External links == | == External links == | ||
| − | |||
| − | |||
| − | |||
| − | |||
| − | |||
| − | |||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.175.html 175] | ** [http://www.chemspider.com/Chemical-Structure.175.html 175] | ||
| + | * METABOLIGHTS : MTBLC15347 | ||
| + | * REFMET : Acetone | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=180 180] | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=15347 15347] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=15347 15347] | ||
| − | * | + | * CAS : 67-64-1 |
| + | * LIGAND-CPD: | ||
| + | ** [http://www.genome.jp/dbget-bin/www_bget?C00207 C00207] | ||
| + | * HMDB : HMDB01659 | ||
{{#set: smiles=CC(=O)C}} | {{#set: smiles=CC(=O)C}} | ||
| − | |||
| − | |||
{{#set: molecular weight=58.08 }} | {{#set: molecular weight=58.08 }} | ||
| + | {{#set: inchi key=InChIKey=CSCPPACGZOOCGX-UHFFFAOYSA-N}} | ||
| + | {{#set: common name=acetone}} | ||
{{#set: common name=dimethylketone|2-propanone|propanone}} | {{#set: common name=dimethylketone|2-propanone|propanone}} | ||
{{#set: consumed by=RXN-8630}} | {{#set: consumed by=RXN-8630}} | ||
| − | |||
Latest revision as of 12:22, 10 January 2019
Contents
Metabolite ACETONE
- smiles:
- CC(=O)C
- molecular weight:
- 58.08
- inchi key:
- InChIKey=CSCPPACGZOOCGX-UHFFFAOYSA-N
- common name:
- acetone
- Synonym(s):
- dimethylketone
- 2-propanone
- propanone
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- CHEMSPIDER:
- METABOLIGHTS : MTBLC15347
- REFMET : Acetone
- PUBCHEM:
- CHEBI:
- CAS : 67-64-1
- LIGAND-CPD:
- HMDB : HMDB01659
