Difference between revisions of "CPD-17271"
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(Created page with "Category:metabolite == Metabolite GAMMA-BUTYROBETAINE == * common-name: ** γ-butyrobetaine * smiles: ** c[n+](cccc([o-])=o)(c)c * inchi-key: ** jhpnvniexxlntr-uhfffa...") |
(Created page with "Category:metabolite == Metabolite CPD-15687 == * common-name: ** 5-cis, 7-trans-3-oxo-tetradecadienoyl-coa * smiles: ** ccccccc=cc=ccc(=o)cc(=o)sccnc(=o)ccnc(=o)c(o)c(c)(c...") |
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| Line 1: | Line 1: | ||
[[Category:metabolite]] | [[Category:metabolite]] | ||
| − | == Metabolite | + | == Metabolite CPD-15687 == |
* common-name: | * common-name: | ||
| − | ** | + | ** 5-cis, 7-trans-3-oxo-tetradecadienoyl-coa |
* smiles: | * smiles: | ||
| − | ** c | + | ** ccccccc=cc=ccc(=o)cc(=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-] |
* inchi-key: | * inchi-key: | ||
| − | ** | + | ** njxbfcfhvuiemz-qtjplklfsa-j |
* molecular-weight: | * molecular-weight: | ||
| − | ** | + | ** 983.813 |
== Reaction(s) known to consume the compound == | == Reaction(s) known to consume the compound == | ||
| − | * [[ | + | * [[RXN-14799]] |
== Reaction(s) known to produce the compound == | == Reaction(s) known to produce the compound == | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
| − | {{#set: common-name= | + | {{#set: common-name=5-cis, 7-trans-3-oxo-tetradecadienoyl-coa}} |
| − | {{#set: inchi-key=inchikey= | + | {{#set: inchi-key=inchikey=njxbfcfhvuiemz-qtjplklfsa-j}} |
| − | {{#set: molecular-weight= | + | {{#set: molecular-weight=983.813}} |
Revision as of 13:10, 14 January 2021
Contents
Metabolite CPD-15687
- common-name:
- 5-cis, 7-trans-3-oxo-tetradecadienoyl-coa
- smiles:
- ccccccc=cc=ccc(=o)cc(=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-]
- inchi-key:
- njxbfcfhvuiemz-qtjplklfsa-j
- molecular-weight:
- 983.813
