Difference between revisions of "SJ20755"

Revision as of 14:20, 26 August 2019

common-name:
- 6-cis-tridecenoyl-coa
smiles:
- ccccccc=cccccc(=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:
- uuivzebypbpkll-dxazuofzsa-j
molecular-weight:
- 957.819

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-8653 CPD-8653] ==
+== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-15637 CPD-15637] ==
 * common-name:
-** betanidin
+** 6-cis-tridecenoyl-coa
 * smiles:
-** c(=[n+]1(c(c([o-])=o)cc2(=c1c=c(o)c(o)=c2)))c=c3(c=c(c(=o)[o-])nc(c([o-])=o)c3)
+** ccccccc=cccccc(=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:
-** xhjkhsxhwjcblx-aaeuagobsa-l
+** uuivzebypbpkll-dxazuofzsa-j
 * molecular-weight:
-** 386.317
+** 957.819
 == Reaction(s) known to consume the compound ==
-* [[RXN-8635]]
+* [[RXN-14771]]
 == Reaction(s) known to produce the compound ==
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=betanidin}}
+{{#set: common-name=6-cis-tridecenoyl-coa}}
-{{#set: inchi-key=inchikey=xhjkhsxhwjcblx-aaeuagobsa-l}}
+{{#set: inchi-key=inchikey=uuivzebypbpkll-dxazuofzsa-j}}
-{{#set: molecular-weight=386.317}}
+{{#set: molecular-weight=957.819}}