Difference between revisions of "ENT-KAUR-16-EN-19-AL"

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(Created page with "Category:metabolite == Metabolite CPD-14271 == * common-name: ** 3-oxoicosanoyl-coa * smiles: ** cccccccccccccccccc(=o)cc(=o)sccnc(=o)ccnc(c(o)c(c)(c)cop([o-])(=o)op([o-])...")
(Created page with "Category:metabolite == Metabolite ENT-KAUR-16-EN-19-AL == * common-name: ** ent-kaurenal * smiles: ** c=c1(c4(cc3(c1)(cc[ch]2(c(c)(c=o)cccc(c)2[ch]3cc4)))) * inchi-key: **...")
 
(6 intermediate revisions by 3 users not shown)
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[[Category:metabolite]]
 
[[Category:metabolite]]
−
== Metabolite CPD-14271 ==
+
== Metabolite ENT-KAUR-16-EN-19-AL ==
 
* common-name:
 
* common-name:
−
** 3-oxoicosanoyl-coa
+
** ent-kaurenal
 
* smiles:
 
* smiles:
−
** cccccccccccccccccc(=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
+
** c=c1(c4(cc3(c1)(cc[ch]2(c(c)(c=o)cccc(c)2[ch]3cc4))))
 
* inchi-key:
 
* inchi-key:
−
** fybvhnzjdvuvlj-ibyujnrcsa-j
+
** jcavdwhqnftfbw-xrnrsjmdsa-n
 
* molecular-weight:
 
* molecular-weight:
−
** 1072.006
+
** 286.456
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN-13298]]
+
* [[RXN-7580]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[RXN-13294]]
+
* [[RXN-5242]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
{{#set: common-name=3-oxoicosanoyl-coa}}
+
{{#set: common-name=ent-kaurenal}}
−
{{#set: inchi-key=inchikey=fybvhnzjdvuvlj-ibyujnrcsa-j}}
+
{{#set: inchi-key=inchikey=jcavdwhqnftfbw-xrnrsjmdsa-n}}
−
{{#set: molecular-weight=1072.006}}
+
{{#set: molecular-weight=286.456}}

Latest revision as of 11:12, 18 March 2021

Metabolite ENT-KAUR-16-EN-19-AL

  • common-name:
    • ent-kaurenal
  • smiles:
    • c=c1(c4(cc3(c1)(cc[ch]2(c(c)(c=o)cccc(c)2[ch]3cc4))))
  • inchi-key:
    • jcavdwhqnftfbw-xrnrsjmdsa-n
  • molecular-weight:
    • 286.456

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

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