Difference between revisions of "CPD-9451"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=SEPO3 SEPO3] == * smiles: ** [O-]P([O-])(O)=[Se] * inchi key: ** InChIKey=JRPHGDYSKGJTKZ-UHFFFA...") |
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-9451 CPD-9451] == * smiles: ** CC(C(C(=O)[O-])=CC(=O)[O-])C * common name: ** 2-isopropylma...") |
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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=CPD-9451 CPD-9451] == |
* smiles: | * smiles: | ||
| − | ** | + | ** CC(C(C(=O)[O-])=CC(=O)[O-])C |
| − | + | ||
| − | + | ||
* common name: | * common name: | ||
| − | ** | + | ** 2-isopropylmaleate |
| + | * inchi key: | ||
| + | ** InChIKey=NJMGRJLQRLFQQX-HYXAFXHYSA-L | ||
* molecular weight: | * molecular weight: | ||
| − | ** | + | ** 156.138 |
* Synonym(s): | * Synonym(s): | ||
| − | ** | + | ** β-isopropylmaleate |
| + | ** 2-isopropylmaleic acid | ||
== 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 == | ||
| + | * [[3-ISOPROPYLMALISOM-RXN]] | ||
| + | * [[RXN-8991]] | ||
== External links == | == External links == | ||
| − | |||
* PUBCHEM: | * PUBCHEM: | ||
| − | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid= | + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=21954611 21954611] |
| − | * HMDB : | + | * HMDB : HMDB12241 |
* LIGAND-CPD: | * LIGAND-CPD: | ||
| − | ** [http://www.genome.jp/dbget-bin/www_bget? | + | ** [http://www.genome.jp/dbget-bin/www_bget?C02631 C02631] |
| + | * CHEMSPIDER: | ||
| + | ** [http://www.chemspider.com/Chemical-Structure.10710392.html 10710392] | ||
* CHEBI: | * CHEBI: | ||
| − | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId= | + | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58085 58085] |
| − | * BIGG : | + | * BIGG : 2ippm |
| − | {{#set: smiles= | + | {{#set: smiles=CC(C(C(=O)[O-])=CC(=O)[O-])C}} |
| − | {{#set: | + | {{#set: common name=2-isopropylmaleate}} |
| − | {{#set: | + | {{#set: inchi key=InChIKey=NJMGRJLQRLFQQX-HYXAFXHYSA-L}} |
| − | {{#set: molecular weight= | + | {{#set: molecular weight=156.138 }} |
| − | {{#set: common name= | + | {{#set: common name=β-isopropylmaleate|2-isopropylmaleic acid}} |
| − | + | {{#set: reversible reaction associated=3-ISOPROPYLMALISOM-RXN|RXN-8991}} | |
| − | {{#set: | + | |
Latest revision as of 20:14, 21 March 2018
Contents
Metabolite CPD-9451
- smiles:
- CC(C(C(=O)[O-])=CC(=O)[O-])C
- common name:
- 2-isopropylmaleate
- inchi key:
- InChIKey=NJMGRJLQRLFQQX-HYXAFXHYSA-L
- molecular weight:
- 156.138
- Synonym(s):
- β-isopropylmaleate
- 2-isopropylmaleic acid
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- PUBCHEM:
- HMDB : HMDB12241
- LIGAND-CPD:
- CHEMSPIDER:
- CHEBI:
- BIGG : 2ippm
"CC(C(C(=O)[O-])=CC(=O)[O-])C" cannot be used as a page name in this wiki.
