Difference between revisions of "CPD-8619"

Latest revision as of 11:14, 18 March 2021

common-name:
- 4α-carboxy-5α-cholesta-8-en-3β-ol
smiles:
- cc(c)cccc([ch]4(c1(c)([ch](c2(=c(cc1)c3(c)([ch](cc2)c(c([o-])=o)c(o)cc3)))cc4)))c
inchi-key:
- rodbxvvnkjcwqr-gsqagghasa-m
molecular-weight:
- 429.662

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-12129 ==
+== Metabolite CPD-8619 ==
 * common-name:
-** menaquinol-12
+** 4&alpha;-carboxy-5&alpha;-cholesta-8-en-3&beta;-ol
 * smiles:
-** cc(=cccc(=cccc(=cccc(=cccc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=ccc1(c(c)=c(o)c2(c=cc=cc(c(o)=1)=2)))c)c)c)c
+** cc(c)cccc([ch]4(c1(c)([ch](c2(=c(cc1)c3(c)([ch](cc2)c(c([o-])=o)c(o)cc3)))cc4)))c
 * inchi-key:
-** fwfjgqgpmzxtlm-wppieqshsa-n
+** rodbxvvnkjcwqr-gsqagghasa-m
 * molecular-weight:
-** 991.617
+** 429.662
 == Reaction(s) known to consume the compound ==
+* [[RXN66-23]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-9363]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=menaquinol-12}}
+{{#set: common-name=4&alpha;-carboxy-5&alpha;-cholesta-8-en-3&beta;-ol}}
-{{#set: inchi-key=inchikey=fwfjgqgpmzxtlm-wppieqshsa-n}}
+{{#set: inchi-key=inchikey=rodbxvvnkjcwqr-gsqagghasa-m}}
-{{#set: molecular-weight=991.617}}
+{{#set: molecular-weight=429.662}}