Difference between revisions of "ALLO-THR"
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(Created page with "Category:metabolite == Metabolite CIS-ACONITATE == * smiles: ** c([o-])(=o)c(=cc(=o)[o-])cc(=o)[o-] * common-name: ** cis-aconitate * inchi-key: ** gtzcvfvgugfeme-iwqzzhsr...") |
(Created page with "Category:metabolite == Metabolite CPD-7418 == * smiles: ** c(c=cc1(=c(c=cc=c1)o))(=o)[o-] * common-name: ** coumarinate * inchi-key: ** pmowtihvnwzyfi-waywqwqtsa-m * molec...") |
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| Line 1: | Line 1: | ||
[[Category:metabolite]] | [[Category:metabolite]] | ||
| − | == Metabolite | + | == Metabolite CPD-7418 == |
* smiles: | * smiles: | ||
| − | ** c( | + | ** c(c=cc1(=c(c=cc=c1)o))(=o)[o-] |
* common-name: | * common-name: | ||
| − | ** | + | ** coumarinate |
* inchi-key: | * inchi-key: | ||
| − | ** | + | ** pmowtihvnwzyfi-waywqwqtsa-m |
* molecular-weight: | * molecular-weight: | ||
| − | ** | + | ** 163.152 |
== Reaction(s) known to consume the compound == | == Reaction(s) known to consume the compound == | ||
| − | * [[ | + | * [[RXN-8037]] |
| − | |||
== Reaction(s) known to produce the compound == | == Reaction(s) known to produce the compound == | ||
| − | * [[ | + | * [[RXN-8036]] |
| − | |||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
| − | {{#set: common-name= | + | {{#set: common-name=coumarinate}} |
| − | {{#set: inchi-key=inchikey= | + | {{#set: inchi-key=inchikey=pmowtihvnwzyfi-waywqwqtsa-m}} |
| − | {{#set: molecular-weight= | + | {{#set: molecular-weight=163.152}} |
Revision as of 15:27, 13 January 2021
Contents
Metabolite CPD-7418
- smiles:
- c(c=cc1(=c(c=cc=c1)o))(=o)[o-]
- common-name:
- coumarinate
- inchi-key:
- pmowtihvnwzyfi-waywqwqtsa-m
- molecular-weight:
- 163.152
