Difference between revisions of "SJ22411"

Revision as of 09:23, 27 August 2019

common-name:
- (3r)-hydroxy-auricoloyl-coa
smiles:
- ccc=cccc(o)cc=ccccccccc(o)cc(=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-]
inchi-key:
- xtsclycoojhttr-ktfrusdtsa-j
molecular-weight:
- 1085.989

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7088 CPD-7088] ==
+== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17402 CPD-17402] ==
 * common-name:
-** (2r,3s,4s)-leucodelphinidin
+** (3r)-hydroxy-auricoloyl-coa
 * smiles:
-** c3(c(c2(oc1(=cc(=cc(=c1c(c2o)o)o)o)))=cc(o)=c(c(o)=3)o)
+** ccc=cccc(o)cc=ccccccccc(o)cc(=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-]
 * inchi-key:
-** zeacokjoqlaytd-souvjxgzsa-n
+** xtsclycoojhttr-ktfrusdtsa-j
 * molecular-weight:
-** 322.271
+** 1085.989
 == Reaction(s) known to consume the compound ==
+* [[RXN-16155]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-7784]]
+* [[RXN-16154]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=(2r,3s,4s)-leucodelphinidin}}
+{{#set: common-name=(3r)-hydroxy-auricoloyl-coa}}
-{{#set: inchi-key=inchikey=zeacokjoqlaytd-souvjxgzsa-n}}
+{{#set: inchi-key=inchikey=xtsclycoojhttr-ktfrusdtsa-j}}
-{{#set: molecular-weight=322.271}}
+{{#set: molecular-weight=1085.989}}