Difference between revisions of "4-TRIMETHYLAMMONIOBUTANAL"

From metabolic_network
Jump to navigation Jump to search
(Created page with "Category:metabolite == Metabolite PHENYLETHYLAMINE == * common-name: ** 2-phenylethylamine * smiles: ** c([n+])cc1(=cc=cc=c1) * inchi-key: ** bhhgxplmpwcghp-uhfffaoysa-o *...")
(Created page with "Category:metabolite == Metabolite CPD-14274 == * common-name: ** 3-oxo-cerotoyl-coa * smiles: ** cccccccccccccccccccccccc(=o)cc(=o)sccnc(=o)ccnc(c(o)c(c)(c)cop([o-])(=o)op...")
Line 1: Line 1:
 
[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite PHENYLETHYLAMINE ==
+
== Metabolite CPD-14274 ==
 
* common-name:
 
* common-name:
** 2-phenylethylamine
+
** 3-oxo-cerotoyl-coa
 
* smiles:
 
* smiles:
** c([n+])cc1(=cc=cc=c1)
+
** cccccccccccccccccccccccc(=o)cc(=o)sccnc(=o)ccnc(c(o)c(c)(c)cop([o-])(=o)op([o-])(=o)occ1(c(op(=o)([o-])[o-])c(o)c(o1)n3(c=nc2(c(n)=nc=nc=23))))=o
 
* inchi-key:
 
* inchi-key:
** bhhgxplmpwcghp-uhfffaoysa-o
+
** vomuifobqmyjpj-cpigopahsa-j
 
* molecular-weight:
 
* molecular-weight:
** 122.189
+
** 1156.166
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-10817]]
+
* [[RXN-13301]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN-13296]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=2-phenylethylamine}}
+
{{#set: common-name=3-oxo-cerotoyl-coa}}
{{#set: inchi-key=inchikey=bhhgxplmpwcghp-uhfffaoysa-o}}
+
{{#set: inchi-key=inchikey=vomuifobqmyjpj-cpigopahsa-j}}
{{#set: molecular-weight=122.189}}
+
{{#set: molecular-weight=1156.166}}

Revision as of 11:17, 15 January 2021

Metabolite CPD-14274

  • common-name:
    • 3-oxo-cerotoyl-coa
  • smiles:
    • cccccccccccccccccccccccc(=o)cc(=o)sccnc(=o)ccnc(c(o)c(c)(c)cop([o-])(=o)op([o-])(=o)occ1(c(op(=o)([o-])[o-])c(o)c(o1)n3(c=nc2(c(n)=nc=nc=23))))=o
  • inchi-key:
    • vomuifobqmyjpj-cpigopahsa-j
  • molecular-weight:
    • 1156.166

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality