Difference between revisions of "SJ11713"

Revision as of 09:23, 27 August 2019

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 [http://metacyc.org/META/NEW-IMAGE?object=CPD-10590 CPD-10590] ==
+== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1G-1346 CPD1G-1346] ==
 * common-name:
-** (24r,25r)-3&alpha;,7&alpha;,24-trihydroxy-5&beta;-cholestanoyl coa
+** trehalose-trans-methoxy-mono-mycolate
 * smiles:
-** cc(ccc(o)c(c)c(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)[ch]4(cc[ch]5(c(c)4cc[ch]6([ch]5c(o)c[ch]7(c(c)6ccc(o)c7))))
+** 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:
-** szbmuaijwnjarr-uizkvwqnsa-j
+** amromufvhnpoeq-bzzonohysa-n
 * molecular-weight:
-** 1196.145
+** 1592.571
 == Reaction(s) known to consume the compound ==
 == Reaction(s) known to produce the compound ==
-* [[RXN-9847]]
+* [[RXN1G-1437]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=(24r,25r)-3&alpha;,7&alpha;,24-trihydroxy-5&beta;-cholestanoyl coa}}
+{{#set: common-name=trehalose-trans-methoxy-mono-mycolate}}
-{{#set: inchi-key=inchikey=szbmuaijwnjarr-uizkvwqnsa-j}}
+{{#set: inchi-key=inchikey=amromufvhnpoeq-bzzonohysa-n}}
-{{#set: molecular-weight=1196.145}}
+{{#set: molecular-weight=1592.571}}