Difference between revisions of "CPD1F-140"

Latest revision as of 11:14, 18 March 2021

common-name:
- gibberellin a20
smiles:
- c=c1(c3(o)(cc4(c1)(c([ch]5(c2(c(=o)oc(ccc2)([ch](cc3)4)5)(c)))c([o-])=o)))
inchi-key:
- oxfpycsnyofuch-aodvqfrnsa-m
molecular-weight:
- 331.388

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-71 ==
+== Metabolite CPD1F-140 ==
 * common-name:
-** (25r)-3&alpha;,7&alpha;,12&alpha;-trihydroxy-5&beta;-cholestanoyl-coa
+** gibberellin a20
 * smiles:
-** cc(cccc(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)4c(o)c[ch]6([ch]5c(o)c[ch]7(c(c)6ccc(o)c7))))
+** c=c1(c3(o)(cc4(c1)(c([ch]5(c2(c(=o)oc(ccc2)([ch](cc3)4)5)(c)))c([o-])=o)))
 * inchi-key:
-** mnydliunnocphg-fjwdchqmsa-j
+** oxfpycsnyofuch-aodvqfrnsa-m
 * molecular-weight:
-** 1196.145
+** 331.388
 == Reaction(s) known to consume the compound ==
-* [[1.17.99.3-RXN]]
+* [[RXN-113]]
 == Reaction(s) known to produce the compound ==
-* [[1.17.99.3-RXN]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=(25r)-3&alpha;,7&alpha;,12&alpha;-trihydroxy-5&beta;-cholestanoyl-coa}}
+{{#set: common-name=gibberellin a20}}
-{{#set: inchi-key=inchikey=mnydliunnocphg-fjwdchqmsa-j}}
+{{#set: inchi-key=inchikey=oxfpycsnyofuch-aodvqfrnsa-m}}
-{{#set: molecular-weight=1196.145}}
+{{#set: molecular-weight=331.388}}