Difference between revisions of "SJ14397"
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(Created page with "Category:metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=Sterols Sterols] == * common-name: ** a sterol == Reaction(s) known to consume the compound ==...") |
(Created page with "Category:metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7257 CPD-7257] == * common-name: ** 3α,7α,12α-trihydroxy-24-oxo-5-β-...") |
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| Line 1: | Line 1: | ||
[[Category:metabolite]] | [[Category:metabolite]] | ||
| − | == Metabolite [http://metacyc.org/META/NEW-IMAGE?object= | + | == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7257 CPD-7257] == |
* common-name: | * common-name: | ||
| − | ** | + | ** 3α,7α,12α-trihydroxy-24-oxo-5-β-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: | ||
| + | ** awlxqjgpnlctlm-yfxotmpnsa-j | ||
| + | * molecular-weight: | ||
| + | ** 1210.128 | ||
== Reaction(s) known to consume the compound == | == Reaction(s) known to consume the compound == | ||
| − | * [[ | + | * [[2.3.1.176-RXN]] |
== Reaction(s) known to produce the compound == | == Reaction(s) known to produce the compound == | ||
| − | |||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
| − | {{#set: common-name= | + | {{#set: common-name=3α,7α,12α-trihydroxy-24-oxo-5-β-cholestanoyl coa}} |
| + | {{#set: inchi-key=inchikey=awlxqjgpnlctlm-yfxotmpnsa-j}} | ||
| + | {{#set: molecular-weight=1210.128}} | ||
Revision as of 14:20, 26 August 2019
Contents
Metabolite CPD-7257
- common-name:
- 3α,7α,12α-trihydroxy-24-oxo-5-β-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:
- awlxqjgpnlctlm-yfxotmpnsa-j
- molecular-weight:
- 1210.128
