Difference between revisions of "CPD-9965"

Latest revision as of 11:11, 18 March 2021

common-name:
- icosanoyl-coa
smiles:
- cccccccccccccccccccc(=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:
- jylsvnbjlycssw-ibyujnrcsa-j
molecular-weight:
- 1058.022

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-7409 ==
+== Metabolite CPD-9965 ==
 * common-name:
-** &beta;-cryptoxanthin
+** icosanoyl-coa
 * smiles:
-** cc(=cc=cc=c(c=cc=c(c=cc1(c(c)(c)cc(cc=1c)o))c)c)c=cc=c(c=cc2(=c(cccc(c)(c)2)c))c
+** cccccccccccccccccccc(=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:
-** dmaslkhvqrhnes-fkkupvfpsa-n
+** jylsvnbjlycssw-ibyujnrcsa-j
 * molecular-weight:
-** 552.882
+** 1058.022
 == Reaction(s) known to consume the compound ==
-* [[RXN-8026]]
+* [[RXN-13295]]
+* [[RXN-9356]]
+* [[RXN-9629]]
+* [[RXN1G-460]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-8025]]
+* [[RXN-9356]]
+* [[RXN1G-460]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=&beta;-cryptoxanthin}}
+{{#set: common-name=icosanoyl-coa}}
-{{#set: inchi-key=inchikey=dmaslkhvqrhnes-fkkupvfpsa-n}}
+{{#set: inchi-key=inchikey=jylsvnbjlycssw-ibyujnrcsa-j}}
-{{#set: molecular-weight=552.882}}
+{{#set: molecular-weight=1058.022}}