Difference between revisions of "CPD-14928"

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(Created page with "Category:metabolite == Metabolite CPD-3618 == * common-name: ** 2-oxovalerate * smiles: ** cccc(=o)c(=o)[o-] * inchi-key: ** kdvfrmmrzocfls-uhfffaoysa-m * molecular-weight...")
(Created page with "Category:metabolite == Metabolite CPD-15436 == * common-name: ** (5z)-tetradecenoyl-coa * smiles: ** ccccccccc=ccccc(sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ1(c(op([...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-3618 ==
+
== Metabolite CPD-15436 ==
 
* common-name:
 
* common-name:
** 2-oxovalerate
+
** (5z)-tetradecenoyl-coa
 
* smiles:
 
* smiles:
** cccc(=o)c(=o)[o-]
+
** ccccccccc=ccccc(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-])=o
 
* inchi-key:
 
* inchi-key:
** kdvfrmmrzocfls-uhfffaoysa-m
+
** mrvdzohjmltlhj-stfckwfxsa-j
 
* molecular-weight:
 
* molecular-weight:
** 115.108
+
** 971.845
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-14576]]
 +
* [[RXN-17783]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-14986]]
+
* [[RXN-17782]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=2-oxovalerate}}
+
{{#set: common-name=(5z)-tetradecenoyl-coa}}
{{#set: inchi-key=inchikey=kdvfrmmrzocfls-uhfffaoysa-m}}
+
{{#set: inchi-key=inchikey=mrvdzohjmltlhj-stfckwfxsa-j}}
{{#set: molecular-weight=115.108}}
+
{{#set: molecular-weight=971.845}}

Revision as of 13:09, 14 January 2021

Metabolite CPD-15436

  • common-name:
    • (5z)-tetradecenoyl-coa
  • smiles:
    • ccccccccc=ccccc(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-])=o
  • inchi-key:
    • mrvdzohjmltlhj-stfckwfxsa-j
  • molecular-weight:
    • 971.845

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality