Difference between revisions of "CPD0-2244"
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(Created page with "Category:metabolite == Metabolite CPD-8973 == * common-name: ** methyl parathion * smiles: ** cop(oc1(=cc=c(c=c1)[n+](=o)[o-]))(oc)=s * inchi-key: ** rlbiqvvomopohc-uhfffa...") |
(Created page with "Category:metabolite == Metabolite TRANS-23-DEHYDROADIPYL-COA == * common-name: ** trans-2,3-dehydroadipyl-coa * smiles: ** cc(c)(c(o)c(=o)nccc(=o)nccsc(c=cccc(=o)[o-])=o)c...") |
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| Line 1: | Line 1: | ||
[[Category:metabolite]] | [[Category:metabolite]] | ||
| − | == Metabolite | + | == Metabolite TRANS-23-DEHYDROADIPYL-COA == |
* common-name: | * common-name: | ||
| − | ** | + | ** trans-2,3-dehydroadipyl-coa |
* smiles: | * smiles: | ||
| − | ** | + | ** cc(c)(c(o)c(=o)nccc(=o)nccsc(c=cccc(=o)[o-])=o)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-] |
* inchi-key: | * inchi-key: | ||
| − | ** | + | ** zfxickrxpztfpb-kcqrsjhasa-i |
* molecular-weight: | * molecular-weight: | ||
| − | ** | + | ** 888.606 |
== Reaction(s) known to consume the compound == | == Reaction(s) known to consume the compound == | ||
| − | * [[RXN- | + | * [[RXN-2425]] |
== Reaction(s) known to produce the compound == | == Reaction(s) known to produce the compound == | ||
| + | * [[RXN-2425]] | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
| − | {{#set: common-name= | + | {{#set: common-name=trans-2,3-dehydroadipyl-coa}} |
| − | {{#set: inchi-key=inchikey= | + | {{#set: inchi-key=inchikey=zfxickrxpztfpb-kcqrsjhasa-i}} |
| − | {{#set: molecular-weight= | + | {{#set: molecular-weight=888.606}} |
Revision as of 15:24, 5 January 2021
Contents
Metabolite TRANS-23-DEHYDROADIPYL-COA
- common-name:
- trans-2,3-dehydroadipyl-coa
- smiles:
- cc(c)(c(o)c(=o)nccc(=o)nccsc(c=cccc(=o)[o-])=o)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-]
- inchi-key:
- zfxickrxpztfpb-kcqrsjhasa-i
- molecular-weight:
- 888.606
