Difference between revisions of "PWY-1781"

Revision as of 09:22, 27 August 2019

common-name:
- phenylacetyl-coa
smiles:
- cc(c)(c(o)c(=o)nccc(=o)nccsc(=o)cc1(c=cc=cc=1))cop(=o)(op(=o)(occ2(c(op([o-])(=o)[o-])c(o)c(o2)n4(c3(=c(c(n)=nc=n3)n=c4))))[o-])[o-]
inchi-key:
- zigifdrjfzyeeq-cecatxlmsa-j
molecular-weight:
- 881.637

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-9768 CPD-9768] ==
+== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-207 CPD-207] ==
 * common-name:
-** (2e)-hexadecenoate
+** phenylacetyl-coa
 * smiles:
-** cccccccccccccc=cc(=o)[o-]
+** cc(c)(c(o)c(=o)nccc(=o)nccsc(=o)cc1(c=cc=cc=1))cop(=o)(op(=o)(occ2(c(op([o-])(=o)[o-])c(o)c(o2)n4(c3(=c(c(n)=nc=n3)n=c4))))[o-])[o-]
 * inchi-key:
-** zvrmgcsssyzgsm-ccezhusrsa-m
+** zigifdrjfzyeeq-cecatxlmsa-j
 * molecular-weight:
-** 253.404
+** 881.637
 == Reaction(s) known to consume the compound ==
+* [[RXN-10821]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-16656]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=(2e)-hexadecenoate}}
+{{#set: common-name=phenylacetyl-coa}}
-{{#set: inchi-key=inchikey=zvrmgcsssyzgsm-ccezhusrsa-m}}
+{{#set: inchi-key=inchikey=zigifdrjfzyeeq-cecatxlmsa-j}}
-{{#set: molecular-weight=253.404}}
+{{#set: molecular-weight=881.637}}