Difference between revisions of "CPD-22095"

Latest revision as of 11:14, 18 March 2021

common-name:
- fucosterol
inchi-key:
- oselkochbmdkej-jugjngjrsa-n
molecular-weight:
- 412.698
smiles:
- cc=c(c(c)c)cc[c@@h](c)[c@@h]3(cc[c@@h]4([c@h]2(cc=c1(c[c@@h](o)cc[c@@](c)1[c@h]2cc[c@](c)34))))

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite 3-METHYL-CROTONYL-COA ==
+== Metabolite CPD-22095 ==
 * common-name:
-** 3-methylcrotonyl-coa
+** fucosterol
-* smiles:
-** cc(=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-])c
 * inchi-key:
-** bxipalatiynhjn-zmhdxicwsa-j
+** oselkochbmdkej-jugjngjrsa-n
 * molecular-weight:
-** 845.604
+** 412.698
+* smiles:
+** cc=c(c(c)c)cc[c@@h](c)[c@@h]3(cc[c@@h]4([c@h]2(cc=c1(c[c@@h](o)cc[c@@](c)1[c@h]2cc[c@](c)34))))
 == Reaction(s) known to consume the compound ==
-* [[ECH_LPAREN_3hivcoa_RPAREN_]]
-* [[METHYLCROTONYL-COA-CARBOXYLASE-RXN]]
-* [[RXN-14264]]
 == Reaction(s) known to produce the compound ==
-* [[ECH_LPAREN_3hivcoa_RPAREN_]]
+* [[RXN-22198]]
-* [[IVCDH]]
-* [[RXN-11921]]
-* [[RXN-14264]]
-* [[RXN0-2301]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=3-methylcrotonyl-coa}}
+{{#set: common-name=fucosterol}}
-{{#set: inchi-key=inchikey=bxipalatiynhjn-zmhdxicwsa-j}}
+{{#set: inchi-key=inchikey=oselkochbmdkej-jugjngjrsa-n}}
-{{#set: molecular-weight=845.604}}
+{{#set: molecular-weight=412.698}}