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-7221 ==
+== 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:
-** (3z)-dodec-3-enoyl-coa
+** phyta-2,10,14-trienyl bacteriochlorophyllide a
-* smiles:
-** ccccccccc=ccc(sccnc(ccnc(c(c(cop(op(occ3(c(op(=o)([o-])[o-])c(o)c(n2(c1(n=cn=c(n)c=1n=c2)))o3))(=o)[o-])(=o)[o-])(c)c)o)=o)=o)=o
-* inchi-key:
-** xemivmktvgrftd-qxmhvhedsa-j
 * molecular-weight:
-** 943.792
+** 906.478
 == Reaction(s) known to consume the compound ==
-* [[RXN-7931]]
+* [[RXN-8789]]
+* [[RXN-8790]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-14394]]
+* [[RXN-8789]]
-* [[RXN-7931]]
+* [[RXN-8790]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=(3z)-dodec-3-enoyl-coa}}
+{{#set: common-name=phyta-2,10,14-trienyl bacteriochlorophyllide a}}
-{{#set: inchi-key=inchikey=xemivmktvgrftd-qxmhvhedsa-j}}
+{{#set: molecular-weight=906.478}}
-{{#set: molecular-weight=943.792}}