Difference between revisions of "CPD-19160"

Latest revision as of 19:37, 17 March 2021

common-name:
- 3-oxo-(11z)-octadecenoyl-coa
molecular-weight:
- 1041.936
inchi-key:
- ourowzutgfhrje-saiinbspsa-j
smiles:
- ccccccc=ccccccccc(=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-]

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite 2-ACETO-LACTATE ==
+== Metabolite CPD-19160 ==
 * common-name:
-** (s)-2-acetolactate
+** 3-oxo-(11z)-octadecenoyl-coa
 * molecular-weight:
-** 131.108
+** 1041.936
 * inchi-key:
-** nmdwgegfjubklb-yfkpbyrvsa-m
+** ourowzutgfhrje-saiinbspsa-j
 * smiles:
-** cc(=o)c(c)(o)c(=o)[o-]
+** ccccccc=ccccccccc(=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-]
 == Reaction(s) known to consume the compound ==
-* [[ACETOLACTREDUCTOISOM-RXN]]
+* [[RXN-17787]]
-* [[RXN-6081]]
 == Reaction(s) known to produce the compound ==
-* [[ACETOLACTSYN-RXN]]
+* [[RXN-17786]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=(s)-2-acetolactate}}
+{{#set: common-name=3-oxo-(11z)-octadecenoyl-coa}}
-{{#set: molecular-weight=131.108}}
+{{#set: molecular-weight=1041.936}}
-{{#set: inchi-key=inchikey=nmdwgegfjubklb-yfkpbyrvsa-m}}
+{{#set: inchi-key=inchikey=ourowzutgfhrje-saiinbspsa-j}}