Difference between revisions of "CPD-16001"

Latest revision as of 19:36, 17 March 2021

common-name:
- (11z)-hexadecenoyl-coa
molecular-weight:
- 999.899
inchi-key:
- lfnouyufxgxnnp-ubpkjmqesa-j
smiles:
- ccccc=ccccccccccc(=o)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-]

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-698 ==
+== Metabolite CPD-16001 ==
 * common-name:
-** campest-4-en-3-one
+** (11z)-hexadecenoyl-coa
 * molecular-weight:
-** 398.671
+** 999.899
 * inchi-key:
-** qqiopzfvtihasb-imudckkosa-n
+** lfnouyufxgxnnp-ubpkjmqesa-j
 * smiles:
-** cc(c)c(c)ccc(c)[ch]3(cc[ch]4([ch]2(ccc1(=cc(=o)ccc(c)1[ch]2ccc(c)34))))
+** ccccc=ccccccccccc(=o)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-]
 == Reaction(s) known to consume the compound ==
-* [[RXN-4231]]
+* [[RXN-16557]]
-* [[RXN-711]]
 == Reaction(s) known to produce the compound ==
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=campest-4-en-3-one}}
+{{#set: common-name=(11z)-hexadecenoyl-coa}}
-{{#set: molecular-weight=398.671}}
+{{#set: molecular-weight=999.899}}
-{{#set: inchi-key=inchikey=qqiopzfvtihasb-imudckkosa-n}}
+{{#set: inchi-key=inchikey=lfnouyufxgxnnp-ubpkjmqesa-j}}