Difference between revisions of "SJ12357"

Revision as of 14:20, 26 August 2019

common-name:
- 3-oxo-auricoloyl-coa
smiles:
- ccc=cccc(o)cc=ccccccccc(=o)cc(=o)sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ1(c(op([o-])(=o)[o-])c(o)c(o1)n3(c2(=c(c(n)=nc=n2)n=c3))))[o-])[o-]
inchi-key:
- fgcwebktqlbclr-jrszcninsa-j
molecular-weight:
- 1083.973

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-15684 CPD-15684] ==
+== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17401 CPD-17401] ==
 * common-name:
-** 5-cis, 7-trans-tetradecadienoyl-coa
+** 3-oxo-auricoloyl-coa
 * smiles:
-** ccccccc=cc=ccccc(=o)sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ1(c(op([o-])(=o)[o-])c(o)c(o1)n3(c2(=c(c(n)=nc=n2)n=c3))))[o-])[o-]
+** ccc=cccc(o)cc=ccccccccc(=o)cc(=o)sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ1(c(op([o-])(=o)[o-])c(o)c(o1)n3(c2(=c(c(n)=nc=n2)n=c3))))[o-])[o-]
 * inchi-key:
-** amanzgdvbadzlh-qtjplklfsa-j
+** fgcwebktqlbclr-jrszcninsa-j
 * molecular-weight:
-** 969.83
+** 1083.973
 == Reaction(s) known to consume the compound ==
-* [[RXN-14796]]
+* [[RXN-16154]]
 == Reaction(s) known to produce the compound ==
+* [[RXN-16153]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=5-cis, 7-trans-tetradecadienoyl-coa}}
+{{#set: common-name=3-oxo-auricoloyl-coa}}
-{{#set: inchi-key=inchikey=amanzgdvbadzlh-qtjplklfsa-j}}
+{{#set: inchi-key=inchikey=fgcwebktqlbclr-jrszcninsa-j}}
-{{#set: molecular-weight=969.83}}
+{{#set: molecular-weight=1083.973}}