Difference between revisions of "SJ05626"

Revision as of 09:23, 27 August 2019

common-name:
- trehalose-cis-methoxy-mono-mycolate
smiles:
- ccccccccccccccccccccccccc(c(occ1(oc(c(c(c1o)o)o)oc2(c(c(c(c(o2)co)o)o)o)))=o)c(o)cccccccccccccccccc3(c(ccccccccccccccccc(oc)c(c)cccccccccccccccccc)c3)
inchi-key:
- brqkyadgwzgfar-zvnwtmltsa-n
molecular-weight:
- 1578.544

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-14276 CPD-14276] ==
+== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1G-1345 CPD1G-1345] ==
 * common-name:
-** (3r)-3-hydroxy-behenoyl-coa
+** trehalose-cis-methoxy-mono-mycolate
 * smiles:
-** cccccccccccccccccccc(o)cc(=o)sccnc(=o)ccnc(c(o)c(c)(c)cop([o-])(=o)op([o-])(=o)occ1(c(op(=o)([o-])[o-])c(o)c(o1)n3(c=nc2(c(n)=nc=nc=23))))=o
+** ccccccccccccccccccccccccc(c(occ1(oc(c(c(c1o)o)o)oc2(c(c(c(c(o2)co)o)o)o)))=o)c(o)cccccccccccccccccc3(c(ccccccccccccccccc(oc)c(c)cccccccccccccccccc)c3)
 * inchi-key:
-** vnjqsrvxtrjvaz-zuiqssppsa-j
+** brqkyadgwzgfar-zvnwtmltsa-n
 * molecular-weight:
-** 1102.075
+** 1578.544
 == Reaction(s) known to consume the compound ==
-* [[RXN-13303]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-13299]]
+* [[RXN1G-1436]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=(3r)-3-hydroxy-behenoyl-coa}}
+{{#set: common-name=trehalose-cis-methoxy-mono-mycolate}}
-{{#set: inchi-key=inchikey=vnjqsrvxtrjvaz-zuiqssppsa-j}}
+{{#set: inchi-key=inchikey=brqkyadgwzgfar-zvnwtmltsa-n}}
-{{#set: molecular-weight=1102.075}}
+{{#set: molecular-weight=1578.544}}