Difference between revisions of "PWY-5489"

Revision as of 09:22, 27 August 2019

common-name:
- 5-dehydroavenasterol
smiles:
- cc=c(c(c)c)ccc(c)[ch]3(cc[ch]4(c2(=cc=c1(cc(o)ccc(c)1[ch]2ccc(c)34))))
inchi-key:
- xprwwanupmykmf-hvegqnehsa-n
molecular-weight:
- 410.682

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-730 CPD-730] ==
+== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-4126 CPD-4126] ==
 * common-name:
-** 3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-octanoate
+** 5-dehydroavenasterol
 * smiles:
-** ccc=ccc1(c(ccc(=o)1)cccccccc([o-])=o)
+** cc=c(c(c)c)ccc(c)[ch]3(cc[ch]4(c2(=cc=c1(cc(o)ccc(c)1[ch]2ccc(c)34))))
 * inchi-key:
-** bzxzfdkirzbjep-jmtmcxqrsa-m
+** xprwwanupmykmf-hvegqnehsa-n
 * molecular-weight:
-** 293.425
+** 410.682
 == Reaction(s) known to consume the compound ==
+* [[RXN-4210]]
 == Reaction(s) known to produce the compound ==
-* [[12-OXOPHYTODIENOATE-REDUCTASE-RXN]]
+* [[RXN-4209]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-octanoate}}
+{{#set: common-name=5-dehydroavenasterol}}
-{{#set: inchi-key=inchikey=bzxzfdkirzbjep-jmtmcxqrsa-m}}
+{{#set: inchi-key=inchikey=xprwwanupmykmf-hvegqnehsa-n}}
-{{#set: molecular-weight=293.425}}
+{{#set: molecular-weight=410.682}}