Difference between revisions of "RXN-4821"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-15692 CPD-15692] == * smiles: ** CCCCCCC=CCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1F-133 CPD1F-133] == * smiles: ** CC(=CC=CC=C(C=CC=C(C)C=CC12(C(C)(C)CC(O)CC(O1)(C)2))C)C=CC...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-15692 CPD-15692] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1F-133 CPD1F-133] ==
 
* smiles:
 
* smiles:
** CCCCCCC=CCC(=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-]
+
** CC(=CC=CC=C(C=CC=C(C)C=CC12(C(C)(C)CC(O)CC(O1)(C)2))C)C=CC=C(C)C=CC34(C(C)(C)CC(O)CC(O3)(C)4)
 
* inchi key:
 
* inchi key:
** InChIKey=CQGVNMQHZQJNII-ZJZQAHHTSA-J
+
** InChIKey=SZCBXWMUOPQSOX-WVJDLNGLSA-N
 
* common name:
 
* common name:
** 3-trans-decenoyl-CoA
+
** violaxanthin
 
* molecular weight:
 
* molecular weight:
** 915.738    
+
** 600.88    
 
* Synonym(s):
 
* Synonym(s):
** 3E-decenoyl-CoA
+
** 5,6,5',6'-diepoxy-5,6,5',6'-tetrahydro-β,β-carotene-3,3'-diol
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-7984]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-14803]]
+
* [[RXN-7979]]
 +
* [[RXN-13193]]
 +
* [[ANXANor]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 +
* [[RXN-13185]]
 
== External links  ==
 
== External links  ==
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90657610 90657610]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=448438 448438]
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=84793 84793]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=35288 35288]
{{#set: smiles=CCCCCCC=CCC(=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-]}}
+
* LIGAND-CPD:
{{#set: inchi key=InChIKey=CQGVNMQHZQJNII-ZJZQAHHTSA-J}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C08614 C08614]
{{#set: common name=3-trans-decenoyl-CoA}}
+
* HMDB : HMDB03101
{{#set: molecular weight=915.738   }}
+
{{#set: smiles=CC(=CC=CC=C(C=CC=C(C)C=CC12(C(C)(C)CC(O)CC(O1)(C)2))C)C=CC=C(C)C=CC34(C(C)(C)CC(O)CC(O3)(C)4)}}
{{#set: common name=3E-decenoyl-CoA}}
+
{{#set: inchi key=InChIKey=SZCBXWMUOPQSOX-WVJDLNGLSA-N}}
{{#set: produced by=RXN-14803}}
+
{{#set: common name=violaxanthin}}
 +
{{#set: molecular weight=600.88   }}
 +
{{#set: common name=5,6,5',6'-diepoxy-5,6,5',6'-tetrahydro-β,β-carotene-3,3'-diol}}
 +
{{#set: consumed by=RXN-7984}}
 +
{{#set: produced by=RXN-7979|RXN-13193|ANXANor}}
 +
{{#set: consumed or produced by=RXN-13185}}

Revision as of 16:57, 10 January 2018

Metabolite CPD1F-133

  • smiles:
    • CC(=CC=CC=C(C=CC=C(C)C=CC12(C(C)(C)CC(O)CC(O1)(C)2))C)C=CC=C(C)C=CC34(C(C)(C)CC(O)CC(O3)(C)4)
  • inchi key:
    • InChIKey=SZCBXWMUOPQSOX-WVJDLNGLSA-N
  • common name:
    • violaxanthin
  • molecular weight:
    • 600.88
  • Synonym(s):
    • 5,6,5',6'-diepoxy-5,6,5',6'-tetrahydro-β,β-carotene-3,3'-diol

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links