Difference between revisions of "CPD-687"

Latest revision as of 17:45, 15 January 2021

smiles:
- cc3(=c5(c(c(c(c4(n=c(c(c)=c1(c(c(ccc(=o)[o-])c(=n1)c=c2(c(c)(c)c(ccc(=o)[o-])c(=n2)3))(cc(=o)[o-])c))c(ccc([o-])=o)c(cc(=o)[o-])(c)4)c)[n+]5)cc(=o)[o-])(c)ccc(=o)[o-]))
common-name:
- hydrogenobyrinate
inchi-key:
- alljllmngbkzlt-brpydkqxsa-h
molecular-weight:
- 874.94

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite ACYL-SN-GLYCEROL-3P ==
+== Metabolite CPD-687 ==
+* smiles:
+** cc3(=c5(c(c(c(c4(n=c(c(c)=c1(c(c(ccc(=o)[o-])c(=n1)c=c2(c(c)(c)c(ccc(=o)[o-])c(=n2)3))(cc(=o)[o-])c))c(ccc([o-])=o)c(cc(=o)[o-])(c)4)c)[n+]5)cc(=o)[o-])(c)ccc(=o)[o-]))
 * common-name:
-** a 1-acyl-sn-glycerol 3-phosphate
+** hydrogenobyrinate
+* inchi-key:
+** alljllmngbkzlt-brpydkqxsa-h
+* molecular-weight:
+** 874.94
 == Reaction(s) known to consume the compound ==
-* [[1-ACYLGLYCEROL-3-P-ACYLTRANSFER-RXN]]
+* [[5.4.1.2-RXN]]
-* [[RXN-16032]]
+* [[R341-RXN]]
-* [[RXN-1623]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-9591]]
+* [[5.4.1.2-RXN]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=a 1-acyl-sn-glycerol 3-phosphate}}
+{{#set: common-name=hydrogenobyrinate}}
+{{#set: inchi-key=inchikey=alljllmngbkzlt-brpydkqxsa-h}}
+{{#set: molecular-weight=874.94}}