Difference between revisions of "SJ16902"

Revision as of 09:23, 27 August 2019

common-name:
- (24r,25r)-3α,7α,12α,24-tetrahydroxy-5β-cholestanoyl coa
smiles:
- cc(ccc(o)c(c)c(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-])=o)[ch]4(cc[ch]5(c(c)4c(o)c[ch]6([ch]5c(o)c[ch]7(c(c)6ccc(o)c7))))
inchi-key:
- pxhzoqnodupjkc-mtlgcjaasa-j
molecular-weight:
- 1212.144

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7015 CPD-7015] ==
+== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7275 CPD-7275] ==
+* common-name:
+** (24r,25r)-3&alpha;,7&alpha;,12&alpha;,24-tetrahydroxy-5&beta;-cholestanoyl coa
 * smiles:
-** c=cc2(c(c)=c4(c=c9(c(c)c(ccc(=o)[o-])c5(=n([mg]36(n1(=c(c(cc)=c(co)c1=cc=2n34)c=c7(c(c)=c8(c(=o)[c-](c(oc)=o)c5=c(n67)8)))))9))))
+** cc(ccc(o)c(c)c(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-])=o)[ch]4(cc[ch]5(c(c)4c(o)c[ch]6([ch]5c(o)c[ch]7(c(c)6ccc(o)c7))))
-* common-name:
+* inchi-key:
-** 71-hydroxychlorophyllide a
+** pxhzoqnodupjkc-mtlgcjaasa-j
 * molecular-weight:
-** 628.966
+** 1212.144
 == Reaction(s) known to consume the compound ==
-* [[RXN-7677]]
+* [[1.17.99.3-RXN]]
+* [[4.2.1.107-RXN]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-7676]]
+* [[1.17.99.3-RXN]]
+* [[4.2.1.107-RXN]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=71-hydroxychlorophyllide a}}
+{{#set: common-name=(24r,25r)-3&alpha;,7&alpha;,12&alpha;,24-tetrahydroxy-5&beta;-cholestanoyl coa}}
-{{#set: molecular-weight=628.966}}
+{{#set: inchi-key=inchikey=pxhzoqnodupjkc-mtlgcjaasa-j}}
+{{#set: molecular-weight=1212.144}}