Difference between revisions of "1-CHLORO-24-DINITROBENZENE"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=1-CHLORO-24-DINITROBENZENE 1-CHLORO-24-DINITROBENZENE] == * smiles: ** C1(C=C(Cl)C(=CC=1[N+]([O...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** C1(C=C(Cl)C(=CC=1[N+]([O-])=O)[N+]([O-])=O) | ** C1(C=C(Cl)C(=CC=1[N+]([O-])=O)[N+]([O-])=O) | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 202.554 | ** 202.554 | ||
| + | * inchi key: | ||
| + | ** InChIKey=VYZAHLCBVHPDDF-UHFFFAOYSA-N | ||
| + | * common name: | ||
| + | ** 1-chloro-2,4-dinitrobenzene | ||
* Synonym(s): | * Synonym(s): | ||
** CDNB | ** CDNB | ||
| Line 17: | Line 17: | ||
* [[GST-RXN]] | * [[GST-RXN]] | ||
== External links == | == External links == | ||
| − | * | + | * NCI: |
| − | ** [http:// | + | ** [http://cactus.nci.nih.gov/ncidb2.2/?nsc=6292 6292] |
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.13868426.html 13868426] | ** [http://www.chemspider.com/Chemical-Structure.13868426.html 13868426] | ||
| Line 25: | Line 25: | ||
* LIGAND-CPD: | * LIGAND-CPD: | ||
** [http://www.genome.jp/dbget-bin/www_bget?C14397 C14397] | ** [http://www.genome.jp/dbget-bin/www_bget?C14397 C14397] | ||
| − | * | + | * PUBCHEM: |
| − | ** [http:// | + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6 6] |
{{#set: smiles=C1(C=C(Cl)C(=CC=1[N+]([O-])=O)[N+]([O-])=O)}} | {{#set: smiles=C1(C=C(Cl)C(=CC=1[N+]([O-])=O)[N+]([O-])=O)}} | ||
| − | |||
| − | |||
{{#set: molecular weight=202.554 }} | {{#set: molecular weight=202.554 }} | ||
| + | {{#set: inchi key=InChIKey=VYZAHLCBVHPDDF-UHFFFAOYSA-N}} | ||
| + | {{#set: common name=1-chloro-2,4-dinitrobenzene}} | ||
{{#set: common name=CDNB}} | {{#set: common name=CDNB}} | ||
{{#set: reversible reaction associated=GST-RXN}} | {{#set: reversible reaction associated=GST-RXN}} | ||
Latest revision as of 12:30, 10 January 2019
Contents
Metabolite 1-CHLORO-24-DINITROBENZENE
- smiles:
- C1(C=C(Cl)C(=CC=1[N+]([O-])=O)[N+]([O-])=O)
- molecular weight:
- 202.554
- inchi key:
- InChIKey=VYZAHLCBVHPDDF-UHFFFAOYSA-N
- common name:
- 1-chloro-2,4-dinitrobenzene
- Synonym(s):
- CDNB
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
"C1(C=C(Cl)C(=CC=1[N+]([O-])=O)[N+]([O-])=O)" cannot be used as a page name in this wiki.
