Difference between revisions of "CPD-9099"

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(Created page with "Category:metabolite == Metabolite 5-HYDROXY-FERULIC-ACID == * common-name: ** 5-hydroxyferulate * smiles: ** coc1(c=c(c=cc([o-])=o)c=c(o)c(o)=1) * inchi-key: ** yfxwtvldsk...")
(Created page with "Category:metabolite == Metabolite CPD-8090 == * common-name: ** 1-α-linolenoyl-2-linoleoyl-phosphatidylcholine * smiles: ** ccc=ccc=ccc=ccccccccc(occ(oc(=o)cccccccc=...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite 5-HYDROXY-FERULIC-ACID ==
+
== Metabolite CPD-8090 ==
 
* common-name:
 
* common-name:
** 5-hydroxyferulate
+
** 1-α-linolenoyl-2-linoleoyl-phosphatidylcholine
 
* smiles:
 
* smiles:
** coc1(c=c(c=cc([o-])=o)c=c(o)c(o)=1)
+
** ccc=ccc=ccc=ccccccccc(occ(oc(=o)cccccccc=ccc=cccccc)cop([o-])(=o)occ[n+](c)(c)c)=o
 
* inchi-key:
 
* inchi-key:
** yfxwtvldsksylw-nscuhmnnsa-m
+
** qfdyidgukxrpkh-vslglsmxsa-n
 
* molecular-weight:
 
* molecular-weight:
** 209.178
+
** 780.076
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-3422]]
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* [[RXN-8331]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-1121]]
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* [[RXN-8323]]
 +
* [[RXN-8330]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=5-hydroxyferulate}}
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{{#set: common-name=1-α-linolenoyl-2-linoleoyl-phosphatidylcholine}}
{{#set: inchi-key=inchikey=yfxwtvldsksylw-nscuhmnnsa-m}}
+
{{#set: inchi-key=inchikey=qfdyidgukxrpkh-vslglsmxsa-n}}
{{#set: molecular-weight=209.178}}
+
{{#set: molecular-weight=780.076}}

Revision as of 08:26, 15 March 2021

Metabolite CPD-8090

  • common-name:
    • 1-α-linolenoyl-2-linoleoyl-phosphatidylcholine
  • smiles:
    • ccc=ccc=ccc=ccccccccc(occ(oc(=o)cccccccc=ccc=cccccc)cop([o-])(=o)occ[n+](c)(c)c)=o
  • inchi-key:
    • qfdyidgukxrpkh-vslglsmxsa-n
  • molecular-weight:
    • 780.076

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality