Difference between revisions of "PHENYL-PYRUVATE"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PHENYL-PYRUVATE PHENYL-PYRUVATE] == * smiles: ** C([O-])(=O)C(=O)CC1(=CC=CC=C1) * inchi key: **...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** C([O-])(=O)C(=O)CC1(=CC=CC=C1) | ** C([O-])(=O)C(=O)CC1(=CC=CC=C1) | ||
| + | * molecular weight: | ||
| + | ** 163.152 | ||
* inchi key: | * inchi key: | ||
** InChIKey=BTNMPGBKDVTSJY-UHFFFAOYSA-M | ** InChIKey=BTNMPGBKDVTSJY-UHFFFAOYSA-M | ||
* common name: | * common name: | ||
** 2-oxo-3-phenylpropanoate | ** 2-oxo-3-phenylpropanoate | ||
| − | |||
| − | |||
* Synonym(s): | * Synonym(s): | ||
** α-ketohydrocinnamic acid | ** α-ketohydrocinnamic acid | ||
| Line 20: | Line 20: | ||
== Reaction(s) known to produce the compound == | == Reaction(s) known to produce the compound == | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
| + | * [[PHEAMINOTRANS-RXN]] | ||
* [[RXN-10814]] | * [[RXN-10814]] | ||
* [[PREPHENATEDEHYDRAT-RXN]] | * [[PREPHENATEDEHYDRAT-RXN]] | ||
| − | |||
== External links == | == External links == | ||
| − | |||
* METABOLIGHTS : MTBLC18005 | * METABOLIGHTS : MTBLC18005 | ||
| − | * | + | * BIGG : phpyr |
| − | * | + | * CAS : 156-06-9 |
* HMDB : HMDB00205 | * HMDB : HMDB00205 | ||
| − | |||
| − | |||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.3784710.html 3784710] | ** [http://www.chemspider.com/Chemical-Structure.3784710.html 3784710] | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=18005 18005] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=18005 18005] | ||
| − | * | + | * LIGAND-CPD: |
| + | ** [http://www.genome.jp/dbget-bin/www_bget?C00166 C00166] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=4592697 4592697] | ||
{{#set: smiles=C([O-])(=O)C(=O)CC1(=CC=CC=C1)}} | {{#set: smiles=C([O-])(=O)C(=O)CC1(=CC=CC=C1)}} | ||
| + | {{#set: molecular weight=163.152 }} | ||
{{#set: inchi key=InChIKey=BTNMPGBKDVTSJY-UHFFFAOYSA-M}} | {{#set: inchi key=InChIKey=BTNMPGBKDVTSJY-UHFFFAOYSA-M}} | ||
{{#set: common name=2-oxo-3-phenylpropanoate}} | {{#set: common name=2-oxo-3-phenylpropanoate}} | ||
| − | |||
{{#set: common name=α-ketohydrocinnamic acid|3-phenyl-2-oxopropanoate|phenylpyruvate|3-phenylpyruvate|3-phenylpyruvic acid}} | {{#set: common name=α-ketohydrocinnamic acid|3-phenyl-2-oxopropanoate|phenylpyruvate|3-phenylpyruvate|3-phenylpyruvic acid}} | ||
{{#set: consumed by=RXN-10815}} | {{#set: consumed by=RXN-10815}} | ||
| − | {{#set: reversible reaction associated=RXN-10814|PREPHENATEDEHYDRAT | + | {{#set: reversible reaction associated=PHEAMINOTRANS-RXN|RXN-10814|PREPHENATEDEHYDRAT-RXN}} |
Latest revision as of 16:52, 9 January 2019
Contents
Metabolite PHENYL-PYRUVATE
- smiles:
- C([O-])(=O)C(=O)CC1(=CC=CC=C1)
- molecular weight:
- 163.152
- inchi key:
- InChIKey=BTNMPGBKDVTSJY-UHFFFAOYSA-M
- common name:
- 2-oxo-3-phenylpropanoate
- Synonym(s):
- α-ketohydrocinnamic acid
- 3-phenyl-2-oxopropanoate
- phenylpyruvate
- 3-phenylpyruvate
- 3-phenylpyruvic acid
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- METABOLIGHTS : MTBLC18005
- BIGG : phpyr
- CAS : 156-06-9
- HMDB : HMDB00205
- CHEMSPIDER:
- CHEBI:
- LIGAND-CPD:
- PUBCHEM:
"C([O-])(=O)C(=O)CC1(=CC=CC=C1)" cannot be used as a page name in this wiki.
