Difference between revisions of "CPD-10608"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-10608 CPD-10608] == * smiles: ** C1(=CC(=O)OC(=CC(=O)[O-])1) * inchi key: ** InChIKey=AYFXP...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** C1(=CC(=O)OC(=CC(=O)[O-])1) | ** C1(=CC(=O)OC(=CC(=O)[O-])1) | ||
| + | * molecular weight: | ||
| + | ** 139.087 | ||
* inchi key: | * inchi key: | ||
** InChIKey=AYFXPGXAZMFWNH-ONEGZZNKSA-M | ** InChIKey=AYFXPGXAZMFWNH-ONEGZZNKSA-M | ||
* common name: | * common name: | ||
** trans-dienelactone | ** trans-dienelactone | ||
| − | |||
| − | |||
* Synonym(s): | * Synonym(s): | ||
** 2-trans-dienelactone | ** 2-trans-dienelactone | ||
| Line 20: | Line 20: | ||
* PUBCHEM: | * PUBCHEM: | ||
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=9543248 9543248] | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=9543248 9543248] | ||
| − | |||
| − | |||
* LIGAND-CPD: | * LIGAND-CPD: | ||
** [http://www.genome.jp/dbget-bin/www_bget?C12838 C12838] | ** [http://www.genome.jp/dbget-bin/www_bget?C12838 C12838] | ||
| + | * CHEMSPIDER: | ||
| + | ** [http://www.chemspider.com/Chemical-Structure.7822189.html 7822189] | ||
{{#set: smiles=C1(=CC(=O)OC(=CC(=O)[O-])1)}} | {{#set: smiles=C1(=CC(=O)OC(=CC(=O)[O-])1)}} | ||
| + | {{#set: molecular weight=139.087 }} | ||
{{#set: inchi key=InChIKey=AYFXPGXAZMFWNH-ONEGZZNKSA-M}} | {{#set: inchi key=InChIKey=AYFXPGXAZMFWNH-ONEGZZNKSA-M}} | ||
{{#set: common name=trans-dienelactone}} | {{#set: common name=trans-dienelactone}} | ||
| − | |||
{{#set: common name=2-trans-dienelactone|trans-4-carboxymethylenebut-2-en-1,4-olide}} | {{#set: common name=2-trans-dienelactone|trans-4-carboxymethylenebut-2-en-1,4-olide}} | ||
{{#set: consumed by=RXN-9868}} | {{#set: consumed by=RXN-9868}} | ||
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.
