Difference between revisions of "Manual"
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(Created page with "Category:metabolite == Metabolite CPD-13912 == * smiles: ** c(c(c(o)c(c([o-])=o)(c([o-])=o)o)o)o * common-name: ** 2-carboxy-l-threo-pentonate * inchi-key: ** cqirjdzgdxtx...") |
(Created page with "Category:metabolite == Metabolite 2-METHYL-BUTYRYL-COA == * smiles: ** ccc(c)c(=o)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)...") |
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Line 1: | Line 1: | ||
[[Category:metabolite]] | [[Category:metabolite]] | ||
− | == Metabolite | + | == Metabolite 2-METHYL-BUTYRYL-COA == |
* smiles: | * smiles: | ||
− | ** c( | + | ** ccc(c)c(=o)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-] |
* common-name: | * common-name: | ||
− | ** 2- | + | ** 2-methylbutanoyl-coa |
* inchi-key: | * inchi-key: | ||
− | ** | + | ** lynvnydeqmmnmz-xgxnyeovsa-j |
* molecular-weight: | * molecular-weight: | ||
− | ** | + | ** 847.62 |
== Reaction(s) known to consume the compound == | == Reaction(s) known to consume the compound == | ||
+ | * [[2-METHYLACYL-COA-DEHYDROGENASE-RXN]] | ||
+ | * [[2KETO-3METHYLVALERATE-RXN]] | ||
+ | * [[MBCOA-DHLIPOAMIDE-RXN]] | ||
== Reaction(s) known to produce the compound == | == Reaction(s) known to produce the compound == | ||
− | * [[RXN- | + | * [[2-METHYLACYL-COA-DEHYDROGENASE-RXN]] |
+ | * [[2KETO-3METHYLVALERATE-RXN]] | ||
+ | * [[MBCOA-DHLIPOAMIDE-RXN]] | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
− | {{#set: common-name=2- | + | {{#set: common-name=2-methylbutanoyl-coa}} |
− | {{#set: inchi-key=inchikey= | + | {{#set: inchi-key=inchikey=lynvnydeqmmnmz-xgxnyeovsa-j}} |
− | {{#set: molecular-weight= | + | {{#set: molecular-weight=847.62}} |
Revision as of 13:45, 14 January 2021
Contents
Metabolite 2-METHYL-BUTYRYL-COA
- smiles:
- ccc(c)c(=o)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-]
- common-name:
- 2-methylbutanoyl-coa
- inchi-key:
- lynvnydeqmmnmz-xgxnyeovsa-j
- molecular-weight:
- 847.62