Difference between revisions of "CPD-4617"

Revision as of 14:55, 5 January 2021

common-name:
- 3-oxo-(7z)-tetradecenoyl-coa
smiles:
- ccccccc=ccccc(=o)cc(=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:
- bepllrgjvxaeji-twafkmgksa-j
molecular-weight:
- 985.829

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-9896 ==
+== Metabolite CPD-19157 ==
 * common-name:
-** 3,4-dihydroxy-5-all-trans-nonaprenylbenzoate
+** 3-oxo-(7z)-tetradecenoyl-coa
 * smiles:
-** cc(c)=cccc(=cccc(=cccc(=cccc(=cccc(=cccc(=cccc(=cccc(=ccc1(=c(c(=cc(c([o-])=o)=c1)o)o))c)c)c)c)c)c)c)c
+** ccccccc=ccccc(=o)cc(=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:
-** fmsczymouyoenk-opsrswoasa-m
+** bepllrgjvxaeji-twafkmgksa-j
 * molecular-weight:
-** 766.178
+** 985.829
 == Reaction(s) known to consume the compound ==
-* [[RXN-9281]]
+* [[RXN-17795]]
 == Reaction(s) known to produce the compound ==
+* [[RXN-17794]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=3,4-dihydroxy-5-all-trans-nonaprenylbenzoate}}
+{{#set: common-name=3-oxo-(7z)-tetradecenoyl-coa}}
-{{#set: inchi-key=inchikey=fmsczymouyoenk-opsrswoasa-m}}
+{{#set: inchi-key=inchikey=bepllrgjvxaeji-twafkmgksa-j}}
-{{#set: molecular-weight=766.178}}
+{{#set: molecular-weight=985.829}}