Difference between revisions of "RXN1A0-6303"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=1.10.99.2-RXN-CPD-7229/PLASTOQUINONE-9/PROTON//CPD-12829/NICOTINAMIDE_RIBOSE.63. 1.10.99.2-RXN-CPD-...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-13755 CPD-13755] == * smiles: ** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CCC1(C(O)CCC2(C)(C(=O)CC[C...")
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=1.10.99.2-RXN-CPD-7229/PLASTOQUINONE-9/PROTON//CPD-12829/NICOTINAMIDE_RIBOSE.63. 1.10.99.2-RXN-CPD-7229/PLASTOQUINONE-9/PROTON//CPD-12829/NICOTINAMIDE_RIBOSE.63.] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-13755 CPD-13755] ==
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* direction:
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* smiles:
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** REVERSIBLE
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** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CCC1(C(O)CCC2(C)(C(=O)CC[CH]12)))COP(=O)(OP(=O)(OCC3(C(OP([O-])(=O)[O-])C(O)C(O3)N5(C4(=C(C(N)=NC=N4)N=C5))))[O-])[O-]
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* inchi key:
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** InChIKey=AKNIQSRWPADUMX-ODLRQIBISA-J
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* common name:
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** 5-hydroxy-3-[(3aS,4S,5R,7aS)-7a-methyl-1,5-dioxo-octahydro-1H-inden-4-yl]propanoyl-CoA
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* molecular weight:
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** 985.786   
 
* Synonym(s):
 
* Synonym(s):
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** 5OH-HIP-CoA
  
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== Reaction Formula ==
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== Reaction(s) known to consume the compound ==
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* With identifiers:
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== Reaction(s) known to produce the compound ==
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** 1.0 [[CPD-7229]][c] '''+''' 1.0 [[PLASTOQUINONE-9]][c] '''+''' 1.0 [[PROTON]][c] '''<=>''' 1.0 [[NICOTINAMIDE_RIBOSE]][c] '''+''' 1.0 [[CPD-12829]][c]
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* [[RXN-12747]]
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* With common name(s):
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== Reaction(s) of unknown directionality ==
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** 1.0 1-(&beta;-D-ribofuranosyl)-1,4-dihydronicotinamide[c] '''+''' 1.0 plastoquinone-9[c] '''+''' 1.0 H+[c] '''<=>''' 1.0 1-(&beta;-D ribofuranosyl)nicotinamide[c] '''+''' 1.0 plastoquinol-9[c]
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−
 
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== Genes associated with this reaction  ==
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== Pathways  ==
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== Reconstruction information  ==
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* [[gap-filling]]:
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** [[meneco]]:
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*** [[added for gapfilling]]
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== External links  ==
 
== External links  ==
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{{#set: direction=REVERSIBLE}}
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* PUBCHEM:
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{{#set: in pathway=}}
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=86290216 86290216]
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{{#set: reconstruction category=gap-filling}}
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* CHEBI:
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{{#set: reconstruction tool=meneco}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=83738 83738]
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{{#set: reconstruction source=added for gapfilling}}
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{{#set: smiles=CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CCC1(C(O)CCC2(C)(C(=O)CC[CH]12)))COP(=O)(OP(=O)(OCC3(C(OP([O-])(=O)[O-])C(O)C(O3)N5(C4(=C(C(N)=NC=N4)N=C5))))[O-])[O-]}}
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{{#set: inchi key=InChIKey=AKNIQSRWPADUMX-ODLRQIBISA-J}}
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{{#set: common name=5-hydroxy-3-[(3aS,4S,5R,7aS)-7a-methyl-1,5-dioxo-octahydro-1H-inden-4-yl]propanoyl-CoA}}
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{{#set: molecular weight=985.786    }}
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{{#set: common name=5OH-HIP-CoA}}
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{{#set: produced by=RXN-12747}}

Revision as of 11:58, 18 January 2018

Metabolite CPD-13755

  • smiles:
    • CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CCC1(C(O)CCC2(C)(C(=O)CC[CH]12)))COP(=O)(OP(=O)(OCC3(C(OP([O-])(=O)[O-])C(O)C(O3)N5(C4(=C(C(N)=NC=N4)N=C5))))[O-])[O-]
  • inchi key:
    • InChIKey=AKNIQSRWPADUMX-ODLRQIBISA-J
  • common name:
    • 5-hydroxy-3-[(3aS,4S,5R,7aS)-7a-methyl-1,5-dioxo-octahydro-1H-inden-4-yl]propanoyl-CoA
  • molecular weight:
    • 985.786
  • Synonym(s):
    • 5OH-HIP-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CCC1(C(O)CCC2(C)(C(=O)CC[CH]12)))COP(=O)(OP(=O)(OCC3(C(OP([O-])(=O)[O-])C(O)C(O3)N5(C4(=C(C(N)=NC=N4)N=C5))))[O-])[O-" cannot be used as a page name in this wiki.
"5-hydroxy-3-[(3aS,4S,5R,7aS)-7a-methyl-1,5-dioxo-octahydro-1H-inden-4-yl]propanoyl-CoA" cannot be used as a page name in this wiki.


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