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-315 ==
+== Metabolite CPD-10261 ==
 * common-name:
-** cyanocob(iii)alamin
+** (3r)-3-hydroxy-stearoyl-coa
 * smiles:
-** cc4(=c(c)c=c3(n2(c%12(oc(co)c(op(=o)(o[ch](c)cnc(=o)ccc1(c)(c(cc(=o)n)[ch]%11(c8(c)(c(cc(=o)n)(c)c(ccc(=o)n)c7(c(c)=c%10(c(cc(=o)n)(c)c(ccc(=o)n)c9(c=c6(c(c)(c)c(ccc(=o)n)c5(c(c)=c1n([co---]([n+](=c2)c3=c4)(c#n)([n+]=56)([n+]=78)[n+]=9%10)%11)))))))))[o-])c(o)%12))))
+** 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:
-** rmrcnwbmxrmirw-wzhzpdafsa-l
+** wzmaiegyxcoysh-mkpujkmasa-j
 * molecular-weight:
-** 1355.377
+** 1045.968
 == Reaction(s) known to consume the compound ==
-* [[ExchangeSeed-CPD-315]]
+* [[RXN-9545]]
-* [[TransportSeed-CPD-315]]
 == Reaction(s) known to produce the compound ==
-* [[ExchangeSeed-CPD-315]]
-* [[TransportSeed-CPD-315]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=cyanocob(iii)alamin}}
+{{#set: common-name=(3r)-3-hydroxy-stearoyl-coa}}
-{{#set: inchi-key=inchikey=rmrcnwbmxrmirw-wzhzpdafsa-l}}
+{{#set: inchi-key=inchikey=wzmaiegyxcoysh-mkpujkmasa-j}}
-{{#set: molecular-weight=1355.377}}
+{{#set: molecular-weight=1045.968}}