Difference between revisions of "CPD-4127"

Latest revision as of 11:15, 18 March 2021

common-name:
- isofucosterol
smiles:
- cc=c(c(c)c)ccc(c)[ch]3(cc[ch]4([ch]2(cc=c1(cc(o)ccc(c)1[ch]2ccc(c)34))))
inchi-key:
- oselkochbmdkej-wgmizeqosa-n
molecular-weight:
- 412.698

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD1G-772 ==
+== Metabolite CPD-4127 ==
 * common-name:
-** 6-o-trans-methoxy-mycolyl-trehalose 6-phosphate
+** isofucosterol
 * smiles:
-** ccccccccccccccccccccccccccc(c(occ1(oc(c(c(c1o)o)o)oc2(c(c(c(c(o2)cop([o-])(=o)[o-])o)o)o)))=o)c(o)cccccccccccccccc3(cc3c(c)cccccccccccccccc(oc)c(c)cccccccccccccccccc)
+** cc=c(c(c)c)ccc(c)[ch]3(cc[ch]4([ch]2(cc=c1(cc(o)ccc(c)1[ch]2ccc(c)34))))
 * inchi-key:
-** xlnaxspacrjuad-bzzonohysa-l
+** oselkochbmdkej-wgmizeqosa-n
 * molecular-weight:
-** 1670.535
+** 412.698
 == Reaction(s) known to consume the compound ==
-* [[RXN1G-1437]]
 == Reaction(s) known to produce the compound ==
+* [[RXN-4210]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=6-o-trans-methoxy-mycolyl-trehalose 6-phosphate}}
+{{#set: common-name=isofucosterol}}
-{{#set: inchi-key=inchikey=xlnaxspacrjuad-bzzonohysa-l}}
+{{#set: inchi-key=inchikey=oselkochbmdkej-wgmizeqosa-n}}
-{{#set: molecular-weight=1670.535}}
+{{#set: molecular-weight=412.698}}