Difference between revisions of "PWY-6893"

Revision as of 09:22, 27 August 2019

common-name:
- 3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-octanoyl-coa
smiles:
- ccc=ccc1(c(ccc(=o)1)cccccccc(sccnc(=o)ccnc(=o)c(o)c(c)(c)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-])=o)
inchi-key:
- jziqdjlbfktbak-llhoyasasa-j
molecular-weight:
- 1039.92

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-18762 CPD-18762] ==
+== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11517 CPD-11517] ==
 * common-name:
-** 4-hydroxy-2-methyl-4-[(2e,6e)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]quinolin-3(4h)-one 1-oxide
+** 3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-octanoyl-coa
 * smiles:
-** cc(c)=cccc(c)=cccc(c)=ccc2(o)(c(c1(c=cc=cc=1[n+](=c(c)2)[o-]))=o)
+** ccc=ccc1(c(ccc(=o)1)cccccccc(sccnc(=o)ccnc(=o)c(o)c(c)(c)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-])=o)
 * inchi-key:
-** hzbjgdkeajeslm-yefhwucqsa-n
+** jziqdjlbfktbak-llhoyasasa-j
 * molecular-weight:
-** 395.541
+** 1039.92
 == Reaction(s) known to consume the compound ==
-* [[RXN-17334]]
+* [[RXN-10696]]
 == Reaction(s) known to produce the compound ==
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=4-hydroxy-2-methyl-4-[(2e,6e)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]quinolin-3(4h)-one 1-oxide}}
+{{#set: common-name=3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-octanoyl-coa}}
-{{#set: inchi-key=inchikey=hzbjgdkeajeslm-yefhwucqsa-n}}
+{{#set: inchi-key=inchikey=jziqdjlbfktbak-llhoyasasa-j}}
-{{#set: molecular-weight=395.541}}
+{{#set: molecular-weight=1039.92}}