Difference between revisions of "CPD-14271"

Latest revision as of 11:12, 18 March 2021

common-name:
- 3-oxoicosanoyl-coa
smiles:
- cccccccccccccccccc(=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
inchi-key:
- fybvhnzjdvuvlj-ibyujnrcsa-j
molecular-weight:
- 1072.006

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite 2-C-METHYL-D-ERYTHRITOL-4-PHOSPHATE ==
+== Metabolite CPD-14271 ==
 * common-name:
-** 2-c-methyl-d-erythritol 4-phosphate
+** 3-oxoicosanoyl-coa
 * smiles:
-** cc(o)(co)c(o)cop([o-])([o-])=o
+** cccccccccccccccccc(=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
 * inchi-key:
-** xmwhrvnvkdkbrg-uhnvwzdzsa-l
+** fybvhnzjdvuvlj-ibyujnrcsa-j
 * molecular-weight:
-** 214.111
+** 1072.006
 == Reaction(s) known to consume the compound ==
-* [[2.7.7.60-RXN]]
+* [[RXN-13298]]
-* [[DXPREDISOM-RXN]]
 == Reaction(s) known to produce the compound ==
-* [[DXPREDISOM-RXN]]
+* [[RXN-13294]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=2-c-methyl-d-erythritol 4-phosphate}}
+{{#set: common-name=3-oxoicosanoyl-coa}}
-{{#set: inchi-key=inchikey=xmwhrvnvkdkbrg-uhnvwzdzsa-l}}
+{{#set: inchi-key=inchikey=fybvhnzjdvuvlj-ibyujnrcsa-j}}
-{{#set: molecular-weight=214.111}}
+{{#set: molecular-weight=1072.006}}