Difference between revisions of "RXNQT-4366"

Revision as of 18:20, 10 January 2018

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

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 [[Category:Metabolite]]
-== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-13043 CPD-13043] ==
+== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-19490 CPD-19490] ==
 * smiles:
-** C12(=C(C(C([O-])=O)=CN1)C(=O)NC(N)=N2)
+** CSCCCCC(C(=O)C(=O)[O-])C(=O)[O-]
 * inchi key:
-** InChIKey=XIUIRSLBMMTDSK-UHFFFAOYSA-M
+** InChIKey=XXJZWLKRFPCKLB-UHFFFAOYSA-L
 * common name:
-** 7-carboxy-7-deazaguanine
+** 3-isopropyl-7-(methylthio)-2-oxoheptanoate
 * molecular weight:
-** 193.141
+** 232.251
 * Synonym(s):
 == Reaction(s) known to consume the compound ==
-* [[RXN-12093]]
+* [[RXN-18207]]
 == Reaction(s) known to produce the compound ==
 == Reaction(s) of unknown directionality ==
+* [[RXN-18206]]
 == External links  ==
-* PUBCHEM:
+{{#set: smiles=CSCCCCC(C(=O)C(=O)[O-])C(=O)[O-]}}
-** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=49852357 49852357]
+{{#set: inchi key=InChIKey=XXJZWLKRFPCKLB-UHFFFAOYSA-L}}
-* CHEBI:
+{{#set: common name=3-isopropyl-7-(methylthio)-2-oxoheptanoate}}
-** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=61036 61036]
+{{#set: molecular weight=232.251    }}
-{{#set: smiles=C12(=C(C(C([O-])=O)=CN1)C(=O)NC(N)=N2)}}
+{{#set: consumed by=RXN-18207}}
-{{#set: inchi key=InChIKey=XIUIRSLBMMTDSK-UHFFFAOYSA-M}}
+{{#set: consumed or produced by=RXN-18206}}
-{{#set: common name=7-carboxy-7-deazaguanine}}
-{{#set: molecular weight=193.141    }}
-{{#set: consumed by=RXN-12093}}