Difference between revisions of "CPD-173"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=4-CYTIDINE-5-DIPHOSPHO-2-C 4-CYTIDINE-5-DIPHOSPHO-2-C] == * smiles: ** CC(O)(CO)C(O)COP(OP([O-]...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-173 CPD-173] == * smiles: ** C(C1(C=CC=CC=1O))O * inchi key: ** InChIKey=CQRYARSYNCAZFO-UHF...")
 
(2 intermediate revisions by the same user not shown)
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=4-CYTIDINE-5-DIPHOSPHO-2-C 4-CYTIDINE-5-DIPHOSPHO-2-C] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-173 CPD-173] ==
 
* smiles:
 
* smiles:
−
** CC(O)(CO)C(O)COP(OP([O-])(=O)OCC2(C(O)C(O)C(N1(C=CC(N)=NC(=O)1))O2))([O-])=O
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** C(C1(C=CC=CC=1O))O
 
* inchi key:
 
* inchi key:
−
** InChIKey=YFAUKWZNPVBCFF-XHIBXCGHSA-L
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** InChIKey=CQRYARSYNCAZFO-UHFFFAOYSA-N
 
* common name:
 
* common name:
−
** 4-(cytidine 5'-diphospho)-2-C-methyl-D-erythritol
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** salicyl alcohol
 
* molecular weight:
 
* molecular weight:
−
** 519.295    
+
** 124.139    
 
* Synonym(s):
 
* Synonym(s):
−
** CDP-ME
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** saligenin
−
** CDP-methyl-D-erythritol
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** 2-hydroxybenzyl alcohol
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** 4-diphosphocytidyl-2C-methyl-D-erythritol
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** o-hydroxybenzyl alcohol
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** 4-diphosphocytidyl-2-C-methylerythritol
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[2.7.1.148-RXN]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[2.7.7.60-RXN]]
+
* [[RXN-12252]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 +
* CAS : 90-01-7
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=24970669 24970669]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5146 5146]
−
* CHEBI:
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* HMDB : HMDB59709
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57823 57823]
+
−
* BIGG : 216317
+
 
* LIGAND-CPD:
 
* LIGAND-CPD:
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** [http://www.genome.jp/dbget-bin/www_bget?C11435 C11435]
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** [http://www.genome.jp/dbget-bin/www_bget?C02323 C02323]
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{{#set: smiles=CC(O)(CO)C(O)COP(OP([O-])(=O)OCC2(C(O)C(O)C(N1(C=CC(N)=NC(=O)1))O2))([O-])=O}}
+
* CHEMSPIDER:
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{{#set: inchi key=InChIKey=YFAUKWZNPVBCFF-XHIBXCGHSA-L}}
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** [http://www.chemspider.com/Chemical-Structure.4962.html 4962]
−
{{#set: common name=4-(cytidine 5'-diphospho)-2-C-methyl-D-erythritol}}
+
* CHEBI:
−
{{#set: molecular weight=519.295   }}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16464 16464]
−
{{#set: common name=CDP-ME|CDP-methyl-D-erythritol|4-diphosphocytidyl-2C-methyl-D-erythritol|4-diphosphocytidyl-2-C-methylerythritol}}
+
* METABOLIGHTS : MTBLC16464
−
{{#set: consumed by=2.7.1.148-RXN}}
+
{{#set: smiles=C(C1(C=CC=CC=1O))O}}
−
{{#set: produced by=2.7.7.60-RXN}}
+
{{#set: inchi key=InChIKey=CQRYARSYNCAZFO-UHFFFAOYSA-N}}
 +
{{#set: common name=salicyl alcohol}}
 +
{{#set: molecular weight=124.139   }}
 +
{{#set: common name=saligenin|2-hydroxybenzyl alcohol|o-hydroxybenzyl alcohol}}
 +
{{#set: produced by=RXN-12252}}

Latest revision as of 20:53, 21 March 2018

Metabolite CPD-173

  • smiles:
    • C(C1(C=CC=CC=1O))O
  • inchi key:
    • InChIKey=CQRYARSYNCAZFO-UHFFFAOYSA-N
  • common name:
    • salicyl alcohol
  • molecular weight:
    • 124.139
  • Synonym(s):
    • saligenin
    • 2-hydroxybenzyl alcohol
    • o-hydroxybenzyl alcohol

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 90-01-7
  • PUBCHEM:
  • HMDB : HMDB59709
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC16464




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