Difference between revisions of "CPD-476"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-476 CPD-476] == * smiles: ** C(C(CC(C1(C(=CC=CC=1)N))=O)=O)([O-])=O * common name: ** 4-(2-...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** C(C(CC(C1(C(=CC=CC=1)N))=O)=O)([O-])=O | ** C(C(CC(C1(C(=CC=CC=1)N))=O)=O)([O-])=O | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 206.177 | ** 206.177 | ||
| + | * inchi key: | ||
| + | ** InChIKey=CAOVWYZQMPNAFJ-UHFFFAOYSA-M | ||
| + | * common name: | ||
| + | ** 4-(2-aminophenyl)-2,4-dioxobutanoate | ||
* Synonym(s): | * Synonym(s): | ||
== Reaction(s) known to consume the compound == | == Reaction(s) known to consume the compound == | ||
| − | |||
== Reaction(s) known to produce the compound == | == Reaction(s) known to produce the compound == | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
* [[2.6.1.7-RXN]] | * [[2.6.1.7-RXN]] | ||
== External links == | == External links == | ||
| + | * CHEMSPIDER: | ||
| + | ** [http://www.chemspider.com/Chemical-Structure.19951260.html 19951260] | ||
* PUBCHEM: | * PUBCHEM: | ||
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=23615302 23615302] | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=23615302 23615302] | ||
| + | * CHEBI: | ||
| + | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58147 58147] | ||
| + | * GO-TERMS : (REFMET "4-(2-Aminophenyl)-2,4-dioxobutanoic acid" NIL midford 3701443689 NIL NIL) | ||
* HMDB : HMDB00978 | * HMDB : HMDB00978 | ||
* LIGAND-CPD: | * LIGAND-CPD: | ||
** [http://www.genome.jp/dbget-bin/www_bget?C01252 C01252] | ** [http://www.genome.jp/dbget-bin/www_bget?C01252 C01252] | ||
| − | |||
| − | |||
| − | |||
| − | |||
* METABOLIGHTS : MTBLC58147 | * METABOLIGHTS : MTBLC58147 | ||
{{#set: smiles=C(C(CC(C1(C(=CC=CC=1)N))=O)=O)([O-])=O}} | {{#set: smiles=C(C(CC(C1(C(=CC=CC=1)N))=O)=O)([O-])=O}} | ||
| − | |||
| − | |||
{{#set: molecular weight=206.177 }} | {{#set: molecular weight=206.177 }} | ||
| − | {{#set: | + | {{#set: inchi key=InChIKey=CAOVWYZQMPNAFJ-UHFFFAOYSA-M}} |
| + | {{#set: common name=4-(2-aminophenyl)-2,4-dioxobutanoate}} | ||
{{#set: reversible reaction associated=2.6.1.7-RXN}} | {{#set: reversible reaction associated=2.6.1.7-RXN}} | ||
Latest revision as of 11:32, 10 January 2019
Contents
Metabolite CPD-476
- smiles:
- C(C(CC(C1(C(=CC=CC=1)N))=O)=O)([O-])=O
- molecular weight:
- 206.177
- inchi key:
- InChIKey=CAOVWYZQMPNAFJ-UHFFFAOYSA-M
- common name:
- 4-(2-aminophenyl)-2,4-dioxobutanoate
- Synonym(s):
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- CHEMSPIDER:
- PUBCHEM:
- CHEBI:
- GO-TERMS : (REFMET "4-(2-Aminophenyl)-2,4-dioxobutanoic acid" NIL midford 3701443689 NIL NIL)
- HMDB : HMDB00978
- LIGAND-CPD:
- METABOLIGHTS : MTBLC58147
"C(C(CC(C1(C(=CC=CC=1)N))=O)=O)([O-])=O" cannot be used as a page name in this wiki.
