Difference between revisions of "1-7-DIMETHYLXANTHINE"

Latest revision as of 20:37, 21 March 2018

@@ Line 1: / Line 1: @@
 [[Category:Metabolite]]
-== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=Lignoceroyl-ACPs Lignoceroyl-ACPs] ==
+== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=1-7-DIMETHYLXANTHINE 1-7-DIMETHYLXANTHINE] ==
+* smiles:
+** CN2(C=NC1(=C(C(N(C(N1)=O)C)=O)2))
+* inchi key:
+** InChIKey=QUNWUDVFRNGTCO-UHFFFAOYSA-N
 * common name:
-** a lignoceroyl-[acp]
+** paraxanthine
+* molecular weight:
+** 180.166
 * Synonym(s):
+** 1,7-dimethylxanthine
 == Reaction(s) known to consume the compound ==
-* [[RXN-10059]]
+* [[RXN-11520]]
 == Reaction(s) known to produce the compound ==
-* [[RXN1G-526]]
 == Reaction(s) of unknown directionality ==
 == External links  ==
-{{#set: common name=a lignoceroyl-[acp]}}
+* PUBCHEM:
-{{#set: consumed by=RXN-10059}}
+** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=4687 4687]
-{{#set: produced by=RXN1G-526}}
+* HMDB : HMDB01860
+* LIGAND-CPD:
+** [http://www.genome.jp/dbget-bin/www_bget?C13747 C13747]
+* CHEMSPIDER:
+** [http://www.chemspider.com/Chemical-Structure.4525.html 4525]
+* CHEBI:
+** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=25858 25858]
+* METABOLIGHTS : MTBLC25858
+{{#set: smiles=CN2(C=NC1(=C(C(N(C(N1)=O)C)=O)2))}}
+{{#set: inchi key=InChIKey=QUNWUDVFRNGTCO-UHFFFAOYSA-N}}
+{{#set: common name=paraxanthine}}
+{{#set: molecular weight=180.166    }}
+{{#set: common name=1,7-dimethylxanthine}}
+{{#set: consumed by=RXN-11520}}