Difference between revisions of "CPD-19167"

Latest revision as of 11:13, 18 March 2021

common-name:
- 3-oxo-(7z)-hexadecenoyl-coa
smiles:
- ccccccccc=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:
- bucifqoxnyheoo-ydggzukgsa-j
molecular-weight:
- 1013.883

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite DEAMIDO-NAD ==
+== Metabolite CPD-19167 ==
 * common-name:
-** nicotinate adenine dinucleotide
+** 3-oxo-(7z)-hexadecenoyl-coa
 * smiles:
-** c1(c(=cc=c[n+]=1c5(oc(cop(=o)([o-])op(=o)([o-])occ2(oc(c(o)c(o)2)n4(c=nc3(c(n)=nc=nc=34))))c(o)c(o)5))c([o-])=o)
+** ccccccccc=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:
-** senpvezbrzqvst-hisdbwnosa-l
+** bucifqoxnyheoo-ydggzukgsa-j
 * molecular-weight:
-** 662.399
+** 1013.883
 == Reaction(s) known to consume the compound ==
-* [[NAD-SYNTH-GLN-RXN]]
+* [[RXN-17782]]
-* [[NAD-SYNTH-NH3-RXN]]
 == Reaction(s) known to produce the compound ==
-* [[NICONUCADENYLYLTRAN-RXN]]
+* [[RXN-17781]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=nicotinate adenine dinucleotide}}
+{{#set: common-name=3-oxo-(7z)-hexadecenoyl-coa}}
-{{#set: inchi-key=inchikey=senpvezbrzqvst-hisdbwnosa-l}}
+{{#set: inchi-key=inchikey=bucifqoxnyheoo-ydggzukgsa-j}}
-{{#set: molecular-weight=662.399}}
+{{#set: molecular-weight=1013.883}}