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 * inchi key: ** InChIKey=CSCPPACGZOOCGX-UHFFFAOYSA-N *...") |
|||
| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** CC(=O)C | ** CC(=O)C | ||
| + | * molecular weight: | ||
| + | ** 58.08 | ||
* inchi key: | * inchi key: | ||
** InChIKey=CSCPPACGZOOCGX-UHFFFAOYSA-N | ** InChIKey=CSCPPACGZOOCGX-UHFFFAOYSA-N | ||
* common name: | * common name: | ||
** acetone | ** acetone | ||
| − | |||
| − | |||
* Synonym(s): | * Synonym(s): | ||
** dimethylketone | ** dimethylketone | ||
| Line 20: | Line 20: | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
== External links == | == External links == | ||
| + | * METABOLIGHTS : MTBLC15347 | ||
* CAS : 67-64-1 | * CAS : 67-64-1 | ||
| − | |||
| − | |||
* HMDB : HMDB01659 | * HMDB : HMDB01659 | ||
| − | |||
| − | |||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.175.html 175] | ** [http://www.chemspider.com/Chemical-Structure.175.html 175] | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=15347 15347] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=15347 15347] | ||
| − | * | + | * LIGAND-CPD: |
| + | ** [http://www.genome.jp/dbget-bin/www_bget?C00207 C00207] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=180 180] | ||
{{#set: smiles=CC(=O)C}} | {{#set: smiles=CC(=O)C}} | ||
| + | {{#set: molecular weight=58.08 }} | ||
{{#set: inchi key=InChIKey=CSCPPACGZOOCGX-UHFFFAOYSA-N}} | {{#set: inchi key=InChIKey=CSCPPACGZOOCGX-UHFFFAOYSA-N}} | ||
{{#set: common name=acetone}} | {{#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}} | ||
{{#set: produced by=ACETOACETATE-DECARBOXYLASE-RXN}} | {{#set: produced by=ACETOACETATE-DECARBOXYLASE-RXN}} | ||
Latest revision as of 16:13, 9 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
- METABOLIGHTS : MTBLC15347
- CAS : 67-64-1
- HMDB : HMDB01659
- CHEMSPIDER:
- CHEBI:
- LIGAND-CPD:
- PUBCHEM:
