Difference between revisions of "CPD-18379"

Revision as of 18:55, 14 January 2021

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 CPD-11938 ==
+== Metabolite CPD1G-1345 ==
 * common-name:
-** 1d-myo-inositol 1,5-bis(diphosphate) 2,3,4,6-tetrakisphosphate
+** trehalose-cis-methoxy-mono-mycolate
 * smiles:
-** c1(op(=o)([o-])[o-])(c(op(=o)([o-])[o-])c(op([o-])(=o)op([o-])(=o)[o-])c(op([o-])(=o)[o-])c(op(op([o-])(=o)[o-])([o-])=o)c(op([o-])([o-])=o)1)
+** 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:
-** hhqooerqsfjgep-slwywoedsa-a
+** brqkyadgwzgfar-zvnwtmltsa-n
 * molecular-weight:
-** 805.885
+** 1578.544
 == Reaction(s) known to consume the compound ==
-* [[RXN-10965]]
-* [[RXN-10975]]
 == Reaction(s) known to produce the compound ==
-* [[2.7.4.24-RXN]]
+* [[RXN1G-1436]]
-* [[RXN-10965]]
-* [[RXN-10974]]
-* [[RXN-10975]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=1d-myo-inositol 1,5-bis(diphosphate) 2,3,4,6-tetrakisphosphate}}
+{{#set: common-name=trehalose-cis-methoxy-mono-mycolate}}
-{{#set: inchi-key=inchikey=hhqooerqsfjgep-slwywoedsa-a}}
+{{#set: inchi-key=inchikey=brqkyadgwzgfar-zvnwtmltsa-n}}
-{{#set: molecular-weight=805.885}}
+{{#set: molecular-weight=1578.544}}