Difference between revisions of "CPD-10608"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=B-ALANINE B-ALANINE] == * smiles: ** C(C[N+])C([O-])=O * inchi key: ** InChIKey=UCMIRNVEIXFBKS-...") |
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[[Category:Metabolite]] | [[Category:Metabolite]] | ||
| − | == Metabolite [http://metacyc.org/META/NEW-IMAGE?object= | + | == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-10608 CPD-10608] == |
* smiles: | * smiles: | ||
| − | ** | + | ** C1(=CC(=O)OC(=CC(=O)[O-])1) |
| + | * molecular weight: | ||
| + | ** 139.087 | ||
* inchi key: | * inchi key: | ||
| − | ** InChIKey= | + | ** InChIKey=AYFXPGXAZMFWNH-ONEGZZNKSA-M |
* common name: | * common name: | ||
| − | ** | + | ** trans-dienelactone |
| − | + | ||
| − | + | ||
* Synonym(s): | * Synonym(s): | ||
| − | ** | + | ** 2-trans-dienelactone |
| − | ** | + | ** trans-4-carboxymethylenebut-2-en-1,4-olide |
== Reaction(s) known to consume the compound == | == Reaction(s) known to consume the compound == | ||
| − | * [[ | + | * [[RXN-9868]] |
== 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 == | ||
| − | |||
| − | |||
* PUBCHEM: | * PUBCHEM: | ||
| − | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid= | + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=9543248 9543248] |
| − | + | ||
* LIGAND-CPD: | * LIGAND-CPD: | ||
| − | ** [http://www.genome.jp/dbget-bin/www_bget? | + | ** [http://www.genome.jp/dbget-bin/www_bget?C12838 C12838] |
| − | * | + | * CHEMSPIDER: |
| − | ** [http://www. | + | ** [http://www.chemspider.com/Chemical-Structure.7822189.html 7822189] |
| − | + | {{#set: smiles=C1(=CC(=O)OC(=CC(=O)[O-])1)}} | |
| − | {{#set: smiles= | + | {{#set: molecular weight=139.087 }} |
| − | {{#set: inchi key=InChIKey= | + | {{#set: inchi key=InChIKey=AYFXPGXAZMFWNH-ONEGZZNKSA-M}} |
| − | {{#set: common name= | + | {{#set: common name=trans-dienelactone}} |
| − | + | {{#set: common name=2-trans-dienelactone|trans-4-carboxymethylenebut-2-en-1,4-olide}} | |
| − | {{#set: common name= | + | {{#set: consumed by=RXN-9868}} |
| − | + | ||
| − | {{#set: | + | |
Latest revision as of 16:18, 9 January 2019
Contents
Metabolite CPD-10608
- smiles:
- C1(=CC(=O)OC(=CC(=O)[O-])1)
- molecular weight:
- 139.087
- inchi key:
- InChIKey=AYFXPGXAZMFWNH-ONEGZZNKSA-M
- common name:
- trans-dienelactone
- Synonym(s):
- 2-trans-dienelactone
- trans-4-carboxymethylenebut-2-en-1,4-olide
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
"C1(=CC(=O)OC(=CC(=O)[O-])1)" cannot be used as a page name in this wiki.
