Difference between revisions of "2-DEHYDROPANTOATE"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ASCORBATE ASCORBATE] == * smiles: ** C(O)C(O)[CH]1(C([O-])=C(O)C(=O)O1) * inchi key: ** InChIKe...") |
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=2-DEHYDROPANTOATE 2-DEHYDROPANTOATE] == * smiles: ** CC(C(=O)C([O-])=O)(CO)C * inchi key: ** In...") |
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| Line 1: | Line 1: | ||
[[Category:Metabolite]] | [[Category:Metabolite]] | ||
| − | == Metabolite [http://metacyc.org/META/NEW-IMAGE?object= | + | == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=2-DEHYDROPANTOATE 2-DEHYDROPANTOATE] == |
* smiles: | * smiles: | ||
| − | ** | + | ** CC(C(=O)C([O-])=O)(CO)C |
* inchi key: | * inchi key: | ||
| − | ** InChIKey= | + | ** InChIKey=PKVVTUWHANFMQC-UHFFFAOYSA-M |
* common name: | * common name: | ||
| − | ** | + | ** 2-dehydropantoate |
* molecular weight: | * molecular weight: | ||
| − | ** | + | ** 145.135 |
* Synonym(s): | * Synonym(s): | ||
| − | ** | + | ** ketopantoate |
| − | ** | + | ** 2-ketopantoate |
| − | + | ||
| − | + | ||
== Reaction(s) known to consume the compound == | == Reaction(s) known to consume the compound == | ||
| − | * [[ | + | * [[2-DEHYDROPANTOATE-REDUCT-RXN]] |
| − | + | ||
| − | + | ||
| − | + | ||
| − | + | ||
== Reaction(s) known to produce the compound == | == Reaction(s) known to produce the compound == | ||
| − | * [[RXN- | + | * [[RXN-15635]] |
| − | + | ||
| − | + | ||
| − | + | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
| + | * [[3-CH3-2-OXOBUTANOATE-OH-CH3-XFER-RXN]] | ||
== External links == | == External links == | ||
| − | * | + | * DRUGBANK : DB03795 |
| − | + | ||
* PUBCHEM: | * PUBCHEM: | ||
| − | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid= | + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=16755619 16755619] |
| − | + | ||
| − | + | ||
* LIGAND-CPD: | * LIGAND-CPD: | ||
| − | ** [http://www.genome.jp/dbget-bin/www_bget? | + | ** [http://www.genome.jp/dbget-bin/www_bget?C00966 C00966] |
* CHEMSPIDER: | * CHEMSPIDER: | ||
| − | ** [http://www.chemspider.com/Chemical-Structure. | + | ** [http://www.chemspider.com/Chemical-Structure.14649571.html 14649571] |
* CHEBI: | * CHEBI: | ||
| − | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId= | + | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=11561 11561] |
| − | * | + | * BIGG : 36502 |
| − | {{#set: smiles= | + | {{#set: smiles=CC(C(=O)C([O-])=O)(CO)C}} |
| − | {{#set: inchi key=InChIKey= | + | {{#set: inchi key=InChIKey=PKVVTUWHANFMQC-UHFFFAOYSA-M}} |
| − | {{#set: common name= | + | {{#set: common name=2-dehydropantoate}} |
| − | {{#set: molecular weight= | + | {{#set: molecular weight=145.135 }} |
| − | {{#set: common name= | + | {{#set: common name=ketopantoate|2-ketopantoate}} |
| − | {{#set: consumed by= | + | {{#set: consumed by=2-DEHYDROPANTOATE-REDUCT-RXN}} |
| − | {{#set: produced by=RXN- | + | {{#set: produced by=RXN-15635}} |
| + | {{#set: reversible reaction associated=3-CH3-2-OXOBUTANOATE-OH-CH3-XFER-RXN}} | ||
Latest revision as of 20:18, 21 March 2018
Contents
Metabolite 2-DEHYDROPANTOATE
- smiles:
- CC(C(=O)C([O-])=O)(CO)C
- inchi key:
- InChIKey=PKVVTUWHANFMQC-UHFFFAOYSA-M
- common name:
- 2-dehydropantoate
- molecular weight:
- 145.135
- Synonym(s):
- ketopantoate
- 2-ketopantoate
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- DRUGBANK : DB03795
- PUBCHEM:
- LIGAND-CPD:
- CHEMSPIDER:
- CHEBI:
- BIGG : 36502
"CC(C(=O)C([O-])=O)(CO)C" cannot be used as a page name in this wiki.
