Difference between revisions of "1-Alkyl-sn-glycero-3-phosphocholines"
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(Created page with "Category:metabolite == Metabolite L-1-LYSOPHOSPHATIDATE == * common-name: ** 1-oleyl-2-lyso-phosphatidate * smiles: ** ccccccccc=ccccccccc(=o)occ(cop([o-])([o-])=o)o * inc...") |
(Created page with "Category:metabolite == Metabolite CPD-6972 == * common-name: ** 4-(2'-carboxyphenyl)-4-oxobutyryl-coa * smiles: ** cc(cop([o-])(=o)op([o-])(=o)occ3(c(c(c(n2(c=nc1(c(=nc=nc...") |
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Line 1: | Line 1: | ||
[[Category:metabolite]] | [[Category:metabolite]] | ||
− | == Metabolite | + | == Metabolite CPD-6972 == |
* common-name: | * common-name: | ||
− | ** | + | ** 4-(2'-carboxyphenyl)-4-oxobutyryl-coa |
* smiles: | * smiles: | ||
− | ** | + | ** cc(cop([o-])(=o)op([o-])(=o)occ3(c(c(c(n2(c=nc1(c(=nc=nc=12)n)))o3)o)op([o-])(=o)[o-]))(c)c(c(nccc(nccsc(ccc(c4(c=cc=cc(c([o-])=o)=4))=o)=o)=o)=o)o |
* inchi-key: | * inchi-key: | ||
− | ** | + | ** kvaqapqxoxtrae-uhfffaoysa-i |
* molecular-weight: | * molecular-weight: | ||
− | ** | + | ** 966.676 |
== Reaction(s) known to consume the compound == | == Reaction(s) known to consume the compound == | ||
− | * [[RXN | + | * [[NAPHTHOATE-SYN-RXN]] |
== Reaction(s) known to produce the compound == | == Reaction(s) known to produce the compound == | ||
− | * [[ | + | * [[NPHS]] |
− | * [[RXN | + | * [[O-SUCCINYLBENZOATE-COA-LIG-RXN]] |
− | * [[RXN- | + | * [[RXN-7614]] |
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
− | {{#set: common-name= | + | {{#set: common-name=4-(2'-carboxyphenyl)-4-oxobutyryl-coa}} |
− | {{#set: inchi-key=inchikey= | + | {{#set: inchi-key=inchikey=kvaqapqxoxtrae-uhfffaoysa-i}} |
− | {{#set: molecular-weight= | + | {{#set: molecular-weight=966.676}} |
Revision as of 13:08, 14 January 2021
Contents
Metabolite CPD-6972
- common-name:
- 4-(2'-carboxyphenyl)-4-oxobutyryl-coa
- smiles:
- cc(cop([o-])(=o)op([o-])(=o)occ3(c(c(c(n2(c=nc1(c(=nc=nc=12)n)))o3)o)op([o-])(=o)[o-]))(c)c(c(nccc(nccsc(ccc(c4(c=cc=cc(c([o-])=o)=4))=o)=o)=o)=o)o
- inchi-key:
- kvaqapqxoxtrae-uhfffaoysa-i
- molecular-weight:
- 966.676