Difference between revisions of "CAFFEOYL-COA"

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(Created page with "Category:metabolite == Metabolite CPD-6993 == * common-name: ** pinocembrin chalcone * smiles: ** c2(c=cc(c=cc(c1(=c(c=c(c=c(o)1)o)o))=o)=cc=2) * inchi-key: ** loyxtwzxlwh...")
(Created page with "Category:metabolite == Metabolite CAFFEOYL-COA == * common-name: ** trans-caffeoyl-coa * smiles: ** cc(c)(c(o)c(=o)nccc(=o)nccsc(=o)c=cc1(=cc=c(o)c(=c1)o))cop(=o)(op(=o)(o...")
 
(4 intermediate revisions by 2 users not shown)
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-6993 ==
+
== Metabolite CAFFEOYL-COA ==
 
* common-name:
 
* common-name:
** pinocembrin chalcone
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** trans-caffeoyl-coa
 
* smiles:
 
* smiles:
** c2(c=cc(c=cc(c1(=c(c=c(c=c(o)1)o)o))=o)=cc=2)
+
** cc(c)(c(o)c(=o)nccc(=o)nccsc(=o)c=cc1(=cc=c(o)c(=c1)o))cop(=o)(op(=o)(occ2(c(op([o-])(=o)[o-])c(o)c(o2)n4(c3(=c(c(n)=nc=n3)n=c4))))[o-])[o-]
 
* inchi-key:
 
* inchi-key:
** loyxtwzxlwhmbx-votsokgwsa-n
+
** qhrgjmimhclhrg-zseliehesa-j
 
* molecular-weight:
 
* molecular-weight:
** 256.257
+
** 925.647
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-7647]]
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* [[CAFFEOYL-COA-O-METHYLTRANSFERASE-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-7645]]
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* [[RXN-1126]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=pinocembrin chalcone}}
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{{#set: common-name=trans-caffeoyl-coa}}
{{#set: inchi-key=inchikey=loyxtwzxlwhmbx-votsokgwsa-n}}
+
{{#set: inchi-key=inchikey=qhrgjmimhclhrg-zseliehesa-j}}
{{#set: molecular-weight=256.257}}
+
{{#set: molecular-weight=925.647}}

Latest revision as of 11:17, 18 March 2021

Metabolite CAFFEOYL-COA

  • common-name:
    • trans-caffeoyl-coa
  • smiles:
    • cc(c)(c(o)c(=o)nccc(=o)nccsc(=o)c=cc1(=cc=c(o)c(=c1)o))cop(=o)(op(=o)(occ2(c(op([o-])(=o)[o-])c(o)c(o2)n4(c3(=c(c(n)=nc=n3)n=c4))))[o-])[o-]
  • inchi-key:
    • qhrgjmimhclhrg-zseliehesa-j
  • molecular-weight:
    • 925.647

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality