Difference between revisions of "CPD-4126"

Latest revision as of 11:11, 18 March 2021

common-name:
- 5-dehydroavenasterol
smiles:
- cc=c(c(c)c)ccc(c)[ch]3(cc[ch]4(c2(=cc=c1(cc(o)ccc(c)1[ch]2ccc(c)34))))
inchi-key:
- xprwwanupmykmf-hvegqnehsa-n
molecular-weight:
- 410.682

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite GLYCEROL ==
+== Metabolite CPD-4126 ==
 * common-name:
-** glycerol
+** 5-dehydroavenasterol
 * smiles:
-** c(c(o)co)o
+** cc=c(c(c)c)ccc(c)[ch]3(cc[ch]4(c2(=cc=c1(cc(o)ccc(c)1[ch]2ccc(c)34))))
 * inchi-key:
-** pedcqbhivmgvhv-uhfffaoysa-n
+** xprwwanupmykmf-hvegqnehsa-n
 * molecular-weight:
-** 92.094
+** 410.682
 == Reaction(s) known to consume the compound ==
-* [[ALCD19]]
+* [[RXN-4210]]
-* [[GLYCEROL-DEHYDRATASE-RXN]]
-* [[GLYCEROL-DEHYDROGENASE-NADP+-RXN]]
-* [[GLYCEROL-KIN-RXN]]
-* [[biomass_rxn]]
 == Reaction(s) known to produce the compound ==
-* [[3.1.1.23-RXN]]
+* [[RXN-4209]]
-* [[ALCD19]]
-* [[CARDIOLIPSYN-RXN]]
-* [[GLYCEROL-1-PHOSPHATASE-RXN]]
-* [[GLYCEROL-DEHYDROGENASE-NADP+-RXN]]
-* [[GLYCEROL-KIN-RXN]]
-* [[RXN-14073]]
-* [[RXN-14964]]
-* [[RXN-14965]]
-* [[RXN-15088]]
-* [[RXN-15089]]
-* [[RXN-7952-CPD66-43/WATER//GLYCEROL/PALMITATE/PROTON.42.]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=glycerol}}
+{{#set: common-name=5-dehydroavenasterol}}
-{{#set: inchi-key=inchikey=pedcqbhivmgvhv-uhfffaoysa-n}}
+{{#set: inchi-key=inchikey=xprwwanupmykmf-hvegqnehsa-n}}
-{{#set: molecular-weight=92.094}}
+{{#set: molecular-weight=410.682}}