Difference between revisions of "CPD-11410"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17401 CPD-17401] == * smiles: ** CCC=CCCC(O)CC=CCCCCCCCC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11410 CPD-11410] == * smiles: ** C(=O)([O-])CC1(C=C(I)C(=C(I)C=1)OC3(=CC(I)=C(OC2(OC(C([O-]...")
 
(3 intermediate revisions by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17401 CPD-17401] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11410 CPD-11410] ==
 
* smiles:
 
* smiles:
−
** CCC=CCCC(O)CC=CCCCCCCCC(=O)CC(=O)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-]
+
** C(=O)([O-])CC1(C=C(I)C(=C(I)C=1)OC3(=CC(I)=C(OC2(OC(C([O-])=O)C(O)C(O)C(O)2))C=C3))
−
* inchi key:
+
−
** InChIKey=FGCWEBKTQLBCLR-JRSZCNINSA-J
+
 
* common name:
 
* common name:
−
** 3-oxo-auricoloyl-CoA
+
** triiodothyroacetate ether glucuronide
 +
* inchi key:
 +
** InChIKey=VXVBZMWOWMHXTQ-KFYUBCHVSA-L
 
* molecular weight:
 
* molecular weight:
−
** 1083.973    
+
** 796.046    
 
* Synonym(s):
 
* Synonym(s):
−
** 3-oxo-(11Z,17Z)-14R-hydroxy-icosa-11,17-dienoyl-CoA
+
** triiodothyroacetic acid ether glucuronide
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN-16154]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN-10619]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=91819742 91819742]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90659025 90659025]
−
{{#set: smiles=CCC=CCCC(O)CC=CCCCCCCCC(=O)CC(=O)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-]}}
+
{{#set: smiles=C(=O)([O-])CC1(C=C(I)C(=C(I)C=1)OC3(=CC(I)=C(OC2(OC(C([O-])=O)C(O)C(O)C(O)2))C=C3))}}
−
{{#set: inchi key=InChIKey=FGCWEBKTQLBCLR-JRSZCNINSA-J}}
+
{{#set: common name=triiodothyroacetate ether glucuronide}}
−
{{#set: common name=3-oxo-auricoloyl-CoA}}
+
{{#set: inchi key=InChIKey=VXVBZMWOWMHXTQ-KFYUBCHVSA-L}}
−
{{#set: molecular weight=1083.973   }}
+
{{#set: molecular weight=796.046   }}
−
{{#set: common name=3-oxo-(11Z,17Z)-14R-hydroxy-icosa-11,17-dienoyl-CoA}}
+
{{#set: common name=triiodothyroacetic acid ether glucuronide}}
−
{{#set: consumed by=RXN-16154}}
+
{{#set: produced by=RXN-10619}}

Latest revision as of 21:08, 21 March 2018

Metabolite CPD-11410

  • smiles:
    • C(=O)([O-])CC1(C=C(I)C(=C(I)C=1)OC3(=CC(I)=C(OC2(OC(C([O-])=O)C(O)C(O)C(O)2))C=C3))
  • common name:
    • triiodothyroacetate ether glucuronide
  • inchi key:
    • InChIKey=VXVBZMWOWMHXTQ-KFYUBCHVSA-L
  • molecular weight:
    • 796.046
  • Synonym(s):
    • triiodothyroacetic acid ether glucuronide

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"C(=O)([O-])CC1(C=C(I)C(=C(I)C=1)OC3(=CC(I)=C(OC2(OC(C([O-])=O)C(O)C(O)C(O)2))C=C3))" cannot be used as a page name in this wiki.



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