Difference between revisions of "2-ACETO-2-HYDROXY-BUTYRATE"

Revision as of 14:54, 5 January 2021

common-name:
- trehalose-trans-methoxy-mono-mycolate
smiles:
- ccccccccccccccccccccccccccc(c(occ1(oc(c(c(c1o)o)o)oc2(c(c(c(c(o2)co)o)o)o)))=o)c(o)cccccccccccccccc3(cc3c(c)cccccccccccccccc(oc)c(c)cccccccccccccccccc)
inchi-key:
- amromufvhnpoeq-bzzonohysa-n
molecular-weight:
- 1592.571

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-14675 ==
+== Metabolite CPD1G-1346 ==
 * common-name:
-** pristanoyl-coa
+** trehalose-trans-methoxy-mono-mycolate
 * smiles:
-** cc(c)cccc(c)cccc(c)cccc(c)c(=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-]
+** ccccccccccccccccccccccccccc(c(occ1(oc(c(c(c1o)o)o)oc2(c(c(c(c(o2)co)o)o)o)))=o)c(o)cccccccccccccccc3(cc3c(c)cccccccccccccccc(oc)c(c)cccccccccccccccccc)
 * inchi-key:
-** xyjpsqpvcbnzht-tukysrjdsa-j
+** amromufvhnpoeq-bzzonohysa-n
 * molecular-weight:
-** 1043.995
+** 1592.571
 == Reaction(s) known to consume the compound ==
 == Reaction(s) known to produce the compound ==
-* [[RXN66-484]]
+* [[RXN1G-1437]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=pristanoyl-coa}}
+{{#set: common-name=trehalose-trans-methoxy-mono-mycolate}}
-{{#set: inchi-key=inchikey=xyjpsqpvcbnzht-tukysrjdsa-j}}
+{{#set: inchi-key=inchikey=amromufvhnpoeq-bzzonohysa-n}}
-{{#set: molecular-weight=1043.995}}
+{{#set: molecular-weight=1592.571}}