Difference between revisions of "CPD-9089"

Latest revision as of 11:16, 18 March 2021

smiles:
- ccc5(c(c)c9(n6([mg]27(n1(c(c(c)c(ccc(=o)occ=c(c)cccc(c)ccc=c(c)ccc=c(c)c)c=1c4([c-](c(oc)=o)c(=o)c3(=c(c)c(n2c3=4)=cc5=6)))=cc8(=c(c)c(c(c)=o)=c(n78)c=9))))))
common-name:
- phyta-2,10,14-trienyl bacteriochlorophyllide a
molecular-weight:
- 906.478

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-196 ==
+== Metabolite CPD-9089 ==
+* smiles:
+** ccc5(c(c)c9(n6([mg]27(n1(c(c(c)c(ccc(=o)occ=c(c)cccc(c)ccc=c(c)ccc=c(c)c)c=1c4([c-](c(oc)=o)c(=o)c3(=c(c)c(n2c3=4)=cc5=6)))=cc8(=c(c)c(c(c)=o)=c(n78)c=9))))))
 * common-name:
-** octanoyl-coa
+** phyta-2,10,14-trienyl bacteriochlorophyllide a
-* smiles:
-** cccccccc(=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:
-** kqmzyoxobsxmii-cecatxlmsa-j
 * molecular-weight:
-** 889.7
+** 906.478
 == Reaction(s) known to consume the compound ==
-* [[3.1.2.19-RXN-CPD-196/WATER//CPD-195/CO-A/PROTON.35.]]
+* [[RXN-8789]]
-* [[ACACT4]]
+* [[RXN-8790]]
-* [[ACACT4h]]
-* [[ACECOATRANS-RXN-CPD-196/ACET//CPD-195/ACETYL-COA.33.]]
-* [[ACOA80OR]]
-* [[RXN-12669]]
-* [[RXN-14229]]
-* [[THIOESTER-RXN[CCO-CYTOSOL]-CPD-196/WATER//CPD-195/CO-A/PROTON.48.]]
 == Reaction(s) known to produce the compound ==
-* [[ACACT4]]
+* [[RXN-8789]]
-* [[R223-RXN]]
+* [[RXN-8790]]
-* [[RXN-13617]]
-* [[RXN-14229]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=octanoyl-coa}}
+{{#set: common-name=phyta-2,10,14-trienyl bacteriochlorophyllide a}}
-{{#set: inchi-key=inchikey=kqmzyoxobsxmii-cecatxlmsa-j}}
+{{#set: molecular-weight=906.478}}
-{{#set: molecular-weight=889.7}}