Difference between revisions of "SPERMIDINE"

Revision as of 18:56, 14 January 2021

common-name:
- (25s)-3-oxocholest-4-en-26-oate
smiles:
- cc(cccc(c(=o)[o-])c)[ch]3(cc[ch]4([ch]2(ccc1(=cc(=o)ccc(c)1[ch]2ccc(c)34))))
inchi-key:
- psxqjzdfwdkbip-kmppvsslsa-m
molecular-weight:
- 413.619

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-11517 ==
+== Metabolite CPD-13689 ==
 * common-name:
-** 3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-octanoyl-coa
+** (25s)-3-oxocholest-4-en-26-oate
 * 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)
+** cc(cccc(c(=o)[o-])c)[ch]3(cc[ch]4([ch]2(ccc1(=cc(=o)ccc(c)1[ch]2ccc(c)34))))
 * inchi-key:
-** jziqdjlbfktbak-llhoyasasa-j
+** psxqjzdfwdkbip-kmppvsslsa-m
 * molecular-weight:
-** 1039.92
+** 413.619
 == Reaction(s) known to consume the compound ==
-* [[RXN-10696]]
 == Reaction(s) known to produce the compound ==
+* [[RXN-12849]]
+* [[RXN-17644]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-octanoyl-coa}}
+{{#set: common-name=(25s)-3-oxocholest-4-en-26-oate}}
-{{#set: inchi-key=inchikey=jziqdjlbfktbak-llhoyasasa-j}}
+{{#set: inchi-key=inchikey=psxqjzdfwdkbip-kmppvsslsa-m}}
-{{#set: molecular-weight=1039.92}}
+{{#set: molecular-weight=413.619}}