Difference between revisions of "CPD-69"

Latest revision as of 19:16, 21 March 2018

"C([O-])#N" cannot be used as a page name in this wiki.

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 [[Category:Metabolite]]
-== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=Thiols Thiols] ==
+== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-69 CPD-69] ==
+* smiles:
+** C([O-])#N
+* inchi key:
+** InChIKey=XLJMAIOERFSOGZ-UHFFFAOYSA-M
 * common name:
-** a thiol
+** cyanate
+* molecular weight:
+** 42.017
 * Synonym(s):
+** cyanic acid
+** hydrogen cyanate
 == Reaction(s) known to consume the compound ==
-* [[RXN-16226]]
 == Reaction(s) known to produce the compound ==
+* [[RXN-17753]]
 == Reaction(s) of unknown directionality ==
 == External links  ==
-{{#set: common name=a thiol}}
+* CAS : 420-05-3
-{{#set: consumed by=RXN-16226}}
+* BIGG : 37550
+* PUBCHEM:
+** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=105034 105034]
+* HMDB : HMDB02078
+* LIGAND-CPD:
+** [http://www.genome.jp/dbget-bin/www_bget?C01417 C01417]
+* CHEMSPIDER:
+** [http://www.chemspider.com/Chemical-Structure.10445868.html 10445868]
+* CHEBI:
+** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=29195 29195]
+* METABOLIGHTS : MTBLC29195
+{{#set: smiles=C([O-])#N}}
+{{#set: inchi key=InChIKey=XLJMAIOERFSOGZ-UHFFFAOYSA-M}}
+{{#set: common name=cyanate}}
+{{#set: molecular weight=42.017    }}
+{{#set: common name=cyanic acid|hydrogen cyanate}}
+{{#set: produced by=RXN-17753}}