Difference between revisions of "LAUROYLCOA-CPD"

Latest revision as of 11:11, 18 March 2021

common-name:
- lauroyl-coa
smiles:
- cccccccccccc(=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:
- ymcxghlsvalicc-gmhmeamdsa-j
molecular-weight:
- 945.808

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-8607 ==
+== Metabolite LAUROYLCOA-CPD ==
 * common-name:
-** 4,4-dimethyl-14&alpha;-hydroxymethyl-5&alpha;-cholesta-8-en-3&beta;-ol
+** lauroyl-coa
 * smiles:
-** cc(c)cccc([ch]4(c1(c)(c(co)(c2(=c(cc1)c3(c)([ch](cc2)c(c)(c)c(o)cc3)))cc4)))c
+** cccccccccccc(=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:
-** sjpdnxkpbqhpmz-puxrvuthsa-n
+** ymcxghlsvalicc-gmhmeamdsa-j
 * molecular-weight:
-** 444.74
+** 945.808
 == Reaction(s) known to consume the compound ==
-* [[RXN66-12]]
+* [[ACACT6]]
+* [[ACACT6h]]
+* [[ACOA120OR]]
+* [[RXN-14262]]
+* [[RXN-9627]]
 == Reaction(s) known to produce the compound ==
-* [[RXN66-11]]
+* [[ACACT6]]
+* [[RXN-14262]]
+* [[RXN-14268]]
+* [[RXN-16393]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=4,4-dimethyl-14&alpha;-hydroxymethyl-5&alpha;-cholesta-8-en-3&beta;-ol}}
+{{#set: common-name=lauroyl-coa}}
-{{#set: inchi-key=inchikey=sjpdnxkpbqhpmz-puxrvuthsa-n}}
+{{#set: inchi-key=inchikey=ymcxghlsvalicc-gmhmeamdsa-j}}
-{{#set: molecular-weight=444.74}}
+{{#set: molecular-weight=945.808}}