Difference between revisions of "CPD-18773"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=HISTIDINOL HISTIDINOL] == * smiles: ** C1(NC=NC=1CC(CO)[N+]) * inchi key: ** InChIKey=ZQISRDCJN...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-18773 CPD-18773] == * smiles: ** C(O)C1(O)(CC(=O)C(O)=C(O)C1) * common name: ** (R)-demethy...")
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=HISTIDINOL HISTIDINOL] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-18773 CPD-18773] ==
 
* smiles:
 
* smiles:
** C1(NC=NC=1CC(CO)[N+])
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** C(O)C1(O)(CC(=O)C(O)=C(O)C1)
* inchi key:
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** InChIKey=ZQISRDCJNBUVMM-YFKPBYRVSA-O
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* common name:
 
* common name:
** histidinol
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** (R)-demethyl-4-deoxygadusol
 +
* inchi key:
 +
** InChIKey=OWHGXOODGNBQRG-SSDOTTSWSA-N
 
* molecular weight:
 
* molecular weight:
** 142.18    
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** 174.153    
 
* Synonym(s):
 
* Synonym(s):
** histidol
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** (5R)-2,3,5-trihydroxy-5-(hydroxymethyl)cyclohex-2-en-1-one
** L-histidinol
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-8001]]
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* [[RXN-17366]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[HISTIDPHOS-RXN]]
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* [[RXN-17372]]
* [[HISTIDPHOS-RXN[CCO-CYTOSOL]-L-HISTIDINOL-P/WATER//HISTIDINOL/Pi.49.]]
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== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
* [[HISTOLDEHYD-RXN]]
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* [[RXN-17895]]
 
== External links  ==
 
== External links  ==
* CAS : 501-28-0
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{{#set: smiles=C(O)C1(O)(CC(=O)C(O)=C(O)C1)}}
* PUBCHEM:
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{{#set: common name=(R)-demethyl-4-deoxygadusol}}
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6950298 6950298]
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{{#set: inchi key=InChIKey=OWHGXOODGNBQRG-SSDOTTSWSA-N}}
* KNAPSACK : C00007479
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{{#set: molecular weight=174.153   }}
* HMDB : HMDB03431
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{{#set: common name=(5R)-2,3,5-trihydroxy-5-(hydroxymethyl)cyclohex-2-en-1-one}}
* LIGAND-CPD:
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{{#set: consumed by=RXN-17366}}
** [http://www.genome.jp/dbget-bin/www_bget?C00860 C00860]
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{{#set: produced by=RXN-17372}}
* CHEBI:
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{{#set: reversible reaction associated=RXN-17895}}
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57699 57699]
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* BIGG : histd
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{{#set: smiles=C1(NC=NC=1CC(CO)[N+])}}
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{{#set: inchi key=InChIKey=ZQISRDCJNBUVMM-YFKPBYRVSA-O}}
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{{#set: common name=histidinol}}
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{{#set: molecular weight=142.18   }}
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{{#set: common name=histidol|L-histidinol}}
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{{#set: consumed by=RXN-8001}}
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{{#set: produced by=HISTIDPHOS-RXN|HISTIDPHOS-RXN[CCO-CYTOSOL]-L-HISTIDINOL-P/WATER//HISTIDINOL/Pi.49.}}
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{{#set: consumed or produced by=HISTOLDEHYD-RXN}}
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Revision as of 16:46, 23 May 2018

Metabolite CPD-18773

  • smiles:
    • C(O)C1(O)(CC(=O)C(O)=C(O)C1)
  • common name:
    • (R)-demethyl-4-deoxygadusol
  • inchi key:
    • InChIKey=OWHGXOODGNBQRG-SSDOTTSWSA-N
  • molecular weight:
    • 174.153
  • Synonym(s):
    • (5R)-2,3,5-trihydroxy-5-(hydroxymethyl)cyclohex-2-en-1-one

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links