Difference between revisions of "CPD-845"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-845 CPD-845] == * smiles: ** CCl * common name: ** methyl chloride * inchi key: ** InChIKey...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** CCl | ** CCl | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 50.488 | ** 50.488 | ||
| + | * inchi key: | ||
| + | ** InChIKey=NEHMKBQYUWJMIP-UHFFFAOYSA-N | ||
| + | * common name: | ||
| + | ** methyl chloride | ||
* Synonym(s): | * Synonym(s): | ||
** CH3Cl | ** CH3Cl | ||
| Line 19: | Line 19: | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
== External links == | == External links == | ||
| − | |||
| − | |||
| − | |||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.6087.html 6087] | ** [http://www.chemspider.com/Chemical-Structure.6087.html 6087] | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=36014 36014] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=36014 36014] | ||
| + | * CAS : 74-87-3 | ||
| + | * LIGAND-CPD: | ||
| + | ** [http://www.genome.jp/dbget-bin/www_bget?C19446 C19446] | ||
* PUBCHEM: | * PUBCHEM: | ||
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6327 6327] | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6327 6327] | ||
{{#set: smiles=CCl}} | {{#set: smiles=CCl}} | ||
| − | |||
| − | |||
{{#set: molecular weight=50.488 }} | {{#set: molecular weight=50.488 }} | ||
| + | {{#set: inchi key=InChIKey=NEHMKBQYUWJMIP-UHFFFAOYSA-N}} | ||
| + | {{#set: common name=methyl chloride}} | ||
{{#set: common name=CH3Cl|chloromethane|monochloromethane}} | {{#set: common name=CH3Cl|chloromethane|monochloromethane}} | ||
{{#set: produced by=RXN-11267}} | {{#set: produced by=RXN-11267}} | ||
Latest revision as of 15:28, 10 January 2019
Contents
Metabolite CPD-845
- smiles:
- CCl
- molecular weight:
- 50.488
- inchi key:
- InChIKey=NEHMKBQYUWJMIP-UHFFFAOYSA-N
- common name:
- methyl chloride
- Synonym(s):
- CH3Cl
- chloromethane
- monochloromethane
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
