Difference between revisions of "CPD0-1162"

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(Created page with "Category:metabolite == Metabolite CPD-693 == * common-name: ** 2-cis-abscisate * smiles: ** cc(=cc([o-])=o)c=cc1(c(c)(c)cc(=o)c=c(c)1)o * inchi-key: ** jlidbldqvayhne-ykal...")
(Created page with "Category:metabolite == Metabolite CPD0-1162 == * common-name: ** (2e,5z)-tetradecenoyl-coa * smiles: ** ccccccccc=ccc=cc(sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ1(c(...")
 
Line 1: Line 1:
 
[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-693 ==
+
== Metabolite CPD0-1162 ==
 
* common-name:
 
* common-name:
** 2-cis-abscisate
+
** (2e,5z)-tetradecenoyl-coa
 
* smiles:
 
* smiles:
** cc(=cc([o-])=o)c=cc1(c(c)(c)cc(=o)c=c(c)1)o
+
** ccccccccc=ccc=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
 
* inchi-key:
 
* inchi-key:
** jlidbldqvayhne-ykalocixsa-m
+
** jvefyxpcqbmmaa-zmlwrgbosa-j
 
* molecular-weight:
 
* molecular-weight:
** 263.313
+
** 969.83
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN0-5393]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[1.2.3.14-RXN]]
+
* [[RXN-14576]]
 +
* [[RXN-17783]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=2-cis-abscisate}}
+
{{#set: common-name=(2e,5z)-tetradecenoyl-coa}}
{{#set: inchi-key=inchikey=jlidbldqvayhne-ykalocixsa-m}}
+
{{#set: inchi-key=inchikey=jvefyxpcqbmmaa-zmlwrgbosa-j}}
{{#set: molecular-weight=263.313}}
+
{{#set: molecular-weight=969.83}}

Latest revision as of 11:13, 18 March 2021

Metabolite CPD0-1162

  • common-name:
    • (2e,5z)-tetradecenoyl-coa
  • smiles:
    • ccccccccc=ccc=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
  • inchi-key:
    • jvefyxpcqbmmaa-zmlwrgbosa-j
  • molecular-weight:
    • 969.83

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality