Difference between revisions of "CPD-12129"

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(Created page with "Category:metabolite == Metabolite CPD-15370 == * common-name: ** trans-lesqueroloyl-coa * smiles: ** ccccccc(o)cc=ccccccccc=cc(sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(o...")
(Created page with "Category:metabolite == Metabolite CPD-4101 == * common-name: ** 24-methylenelophenol * smiles: ** cc(c)c(=c)ccc(c)[ch]3(cc[ch]4(c2(=cc[ch]1(c(c)c(o)ccc(c)1[ch]2ccc(c)34)))...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-15370 ==
+
== Metabolite CPD-4101 ==
 
* common-name:
 
* common-name:
** trans-lesqueroloyl-coa
+
** 24-methylenelophenol
 
* smiles:
 
* smiles:
** ccccccc(o)cc=ccccccccc=cc(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
+
** cc(c)c(=c)ccc(c)[ch]3(cc[ch]4(c2(=cc[ch]1(c(c)c(o)ccc(c)1[ch]2ccc(c)34))))
 
* inchi-key:
 
* inchi-key:
** fgrjeqcmqcquqf-fscwmumrsa-j
+
** rsmkyrdccsnyfm-aagdoflisa-n
 
* molecular-weight:
 
* molecular-weight:
** 1069.99
+
** 412.698
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[2.1.1.143-RXN]]
 +
* [[RXN-4181-CPD-4101/DIMETHYL-GLYCINE//EPISTEROL/BETAINE.45.]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-14494]]
+
* [[RXN-4181-CPD-4101/DIMETHYL-GLYCINE//EPISTEROL/BETAINE.45.]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=trans-lesqueroloyl-coa}}
+
{{#set: common-name=24-methylenelophenol}}
{{#set: inchi-key=inchikey=fgrjeqcmqcquqf-fscwmumrsa-j}}
+
{{#set: inchi-key=inchikey=rsmkyrdccsnyfm-aagdoflisa-n}}
{{#set: molecular-weight=1069.99}}
+
{{#set: molecular-weight=412.698}}

Revision as of 08:27, 15 March 2021

Metabolite CPD-4101

  • common-name:
    • 24-methylenelophenol
  • smiles:
    • cc(c)c(=c)ccc(c)[ch]3(cc[ch]4(c2(=cc[ch]1(c(c)c(o)ccc(c)1[ch]2ccc(c)34))))
  • inchi-key:
    • rsmkyrdccsnyfm-aagdoflisa-n
  • molecular-weight:
    • 412.698

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality