Difference between revisions of "CPD-18761"

Revision as of 17:42, 23 May 2018

@@ Line 1: / Line 1: @@
 [[Category:Metabolite]]
-== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CO3 CO3] ==
+== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-18761 CPD-18761] ==
 * smiles:
-** C([O-])(=O)[O-]
+** COC1(=CC(=CCCO)C=CC(=O)1)
 * inchi key:
-** InChIKey=BVKZGUZCCUSVTD-UHFFFAOYSA-L
+** InChIKey=ORAJWSYKRGVTDP-UHFFFAOYSA-N
 * common name:
-** carbonate
+** coniferyl alcohol radical
 * molecular weight:
-** 60.009
+** 179.195
 * Synonym(s):
-** CO3
 == Reaction(s) known to consume the compound ==
 == Reaction(s) known to produce the compound ==
+* [[RXN-17352]]
 == Reaction(s) of unknown directionality ==
-* [[RXN-18032]]
 == External links  ==
-* PUBCHEM:
+{{#set: smiles=COC1(=CC(=CCCO)C=CC(=O)1)}}
-** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=19660 19660]
+{{#set: inchi key=InChIKey=ORAJWSYKRGVTDP-UHFFFAOYSA-N}}
-* CHEMSPIDER:
+{{#set: common name=coniferyl alcohol radical}}
-** [http://www.chemspider.com/Chemical-Structure.18519.html 18519]
+{{#set: molecular weight=179.195    }}
-* CHEBI:
+{{#set: produced by=RXN-17352}}
-** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=41609 41609]
-* HMDB : HMDB31453
-{{#set: smiles=C([O-])(=O)[O-]}}
-{{#set: inchi key=InChIKey=BVKZGUZCCUSVTD-UHFFFAOYSA-L}}
-{{#set: common name=carbonate}}
-{{#set: molecular weight=60.009    }}
-{{#set: common name=CO3}}
-{{#set: consumed or produced by=RXN-18032}}