Difference between revisions of "CPD-15677"

Latest revision as of 11:16, 18 March 2021

common-name:
- 4-trans-undecenoyl-coa
smiles:
- ccccccc=cccc(=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:
- afmmiiqkxqnedn-dupkwvsksa-j
molecular-weight:
- 929.765

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-13793 ==
+== Metabolite CPD-15677 ==
 * common-name:
-** 3-oxo-24-ethyl-cholest-5-ene
+** 4-trans-undecenoyl-coa
 * smiles:
-** ccc(c(c)c)ccc(c)[ch]3(cc[ch]4([ch]2(cc=c1(cc(=o)ccc(c)1[ch]2ccc(c)34))))
+** ccccccc=cccc(=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:
-** kyofijxmvnqyfc-xjzkhkohsa-n
+** afmmiiqkxqnedn-dupkwvsksa-j
 * molecular-weight:
-** 412.698
+** 929.765
 == Reaction(s) known to consume the compound ==
-* [[RXN-12789]]
+* [[RXN-14789]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-12789]]
+* [[RXN-14788]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=3-oxo-24-ethyl-cholest-5-ene}}
+{{#set: common-name=4-trans-undecenoyl-coa}}
-{{#set: inchi-key=inchikey=kyofijxmvnqyfc-xjzkhkohsa-n}}
+{{#set: inchi-key=inchikey=afmmiiqkxqnedn-dupkwvsksa-j}}
-{{#set: molecular-weight=412.698}}
+{{#set: molecular-weight=929.765}}