Difference between revisions of "CPD-7418"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7418 CPD-7418] == * smiles: ** C(C=CC1(=C(C=CC=C1)O))(=O)[O-] * inchi key: ** InChIKey=PMOW...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** C(C=CC1(=C(C=CC=C1)O))(=O)[O-] | ** C(C=CC1(=C(C=CC=C1)O))(=O)[O-] | ||
| + | * molecular weight: | ||
| + | ** 163.152 | ||
* inchi key: | * inchi key: | ||
** InChIKey=PMOWTIHVNWZYFI-WAYWQWQTSA-M | ** InChIKey=PMOWTIHVNWZYFI-WAYWQWQTSA-M | ||
* common name: | * common name: | ||
** coumarinate | ** coumarinate | ||
| − | |||
| − | |||
* Synonym(s): | * Synonym(s): | ||
** coumarinic acid | ** coumarinic acid | ||
| Line 17: | Line 17: | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
== External links == | == External links == | ||
| − | * | + | * METABOLIGHTS : MTBLC47921 |
| − | + | ||
| − | + | ||
* LIGAND-CPD: | * LIGAND-CPD: | ||
** [http://www.genome.jp/dbget-bin/www_bget?C05838 C05838] | ** [http://www.genome.jp/dbget-bin/www_bget?C05838 C05838] | ||
| + | * HMDB : HMDB41592 | ||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.20118034.html 20118034] | ** [http://www.chemspider.com/Chemical-Structure.20118034.html 20118034] | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=47921 47921] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=47921 47921] | ||
| − | * | + | * PUBCHEM: |
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=54714352 54714352] | ||
{{#set: smiles=C(C=CC1(=C(C=CC=C1)O))(=O)[O-]}} | {{#set: smiles=C(C=CC1(=C(C=CC=C1)O))(=O)[O-]}} | ||
| + | {{#set: molecular weight=163.152 }} | ||
{{#set: inchi key=InChIKey=PMOWTIHVNWZYFI-WAYWQWQTSA-M}} | {{#set: inchi key=InChIKey=PMOWTIHVNWZYFI-WAYWQWQTSA-M}} | ||
{{#set: common name=coumarinate}} | {{#set: common name=coumarinate}} | ||
| − | |||
{{#set: common name=coumarinic acid}} | {{#set: common name=coumarinic acid}} | ||
{{#set: produced by=RXN-8036}} | {{#set: produced by=RXN-8036}} | ||
Latest revision as of 15:24, 9 January 2019
Contents
Metabolite CPD-7418
- smiles:
- C(C=CC1(=C(C=CC=C1)O))(=O)[O-]
- molecular weight:
- 163.152
- inchi key:
- InChIKey=PMOWTIHVNWZYFI-WAYWQWQTSA-M
- common name:
- coumarinate
- Synonym(s):
- coumarinic acid
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- METABOLIGHTS : MTBLC47921
- LIGAND-CPD:
- HMDB : HMDB41592
- CHEMSPIDER:
- CHEBI:
- PUBCHEM:
"C(C=CC1(=C(C=CC=C1)O))(=O)[O-" cannot be used as a page name in this wiki.
