Difference between revisions of "CPD-10261"

Latest revision as of 11:17, 18 March 2021

common-name:
- (3r)-3-hydroxy-stearoyl-coa
smiles:
- cccccccccccccccc(o)cc(=o)sccnc(=o)ccnc(c(o)c(c)(c)cop([o-])(=o)op([o-])(=o)occ1(c(op(=o)([o-])[o-])c(o)c(o1)n3(c=nc2(c(n)=nc=nc=23))))=o
inchi-key:
- wzmaiegyxcoysh-mkpujkmasa-j
molecular-weight:
- 1045.968

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-14483 ==
+== Metabolite CPD-10261 ==
 * common-name:
-** glycyrrhetinate
+** (3r)-3-hydroxy-stearoyl-coa
 * smiles:
-** cc4(c)(c3(ccc2(c)(c1(c)(ccc5([ch](c1=cc(c2c(c)3ccc(o)4)=o)cc(c([o-])=o)(c)cc5)c))))
+** cccccccccccccccc(o)cc(=o)sccnc(=o)ccnc(c(o)c(c)(c)cop([o-])(=o)op([o-])(=o)occ1(c(op(=o)([o-])[o-])c(o)c(o1)n3(c=nc2(c(n)=nc=nc=23))))=o
 * inchi-key:
-** mpdghejmbkotsu-vopryamfsa-m
+** wzmaiegyxcoysh-mkpujkmasa-j
 * molecular-weight:
-** 469.683
+** 1045.968
 == Reaction(s) known to consume the compound ==
+* [[RXN-9545]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-13494]]
-* [[RXN-13506]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=glycyrrhetinate}}
+{{#set: common-name=(3r)-3-hydroxy-stearoyl-coa}}
-{{#set: inchi-key=inchikey=mpdghejmbkotsu-vopryamfsa-m}}
+{{#set: inchi-key=inchikey=wzmaiegyxcoysh-mkpujkmasa-j}}
-{{#set: molecular-weight=469.683}}
+{{#set: molecular-weight=1045.968}}