Difference between revisions of "1-L-MYO-INOSITOL-1-P"

Revision as of 19:01, 17 March 2021

common-name:
- (3s,6z,9z,12z,15z,18z)-3-hydroxytetracosapentaenoyl-coa
molecular-weight:
- 1120.05
inchi-key:
- nneppynerzejee-vugypbmhsa-j
smiles:
- cccccc=ccc=ccc=ccc=ccc=cccc(o)cc(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-])=o

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite SELENATE ==
+== Metabolite CPD-18493 ==
 * common-name:
-** selenate
+** (3s,6z,9z,12z,15z,18z)-3-hydroxytetracosapentaenoyl-coa
 * molecular-weight:
-** 142.958
+** 1120.05
 * inchi-key:
-** qyhfivbsnowocq-uhfffaoysa-l
+** nneppynerzejee-vugypbmhsa-j
 * smiles:
-** o=[se](=o)([o-])[o-]
+** cccccc=ccc=ccc=ccc=ccc=cccc(o)cc(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-])=o
 == Reaction(s) known to consume the compound ==
-* [[RXN-12720]]
+* [[RXN-17115]]
 == Reaction(s) known to produce the compound ==
+* [[RXN-17114]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=selenate}}
+{{#set: common-name=(3s,6z,9z,12z,15z,18z)-3-hydroxytetracosapentaenoyl-coa}}
-{{#set: molecular-weight=142.958}}
+{{#set: molecular-weight=1120.05}}
-{{#set: inchi-key=inchikey=qyhfivbsnowocq-uhfffaoysa-l}}
+{{#set: inchi-key=inchikey=nneppynerzejee-vugypbmhsa-j}}