Difference between revisions of "CPD-68"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=INOSINE INOSINE] == * smiles: ** C(O)C1(OC(C(O)C(O)1)N3(C=NC2(C(=O)NC=NC=23))) * inchi key: **...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-68 CPD-68] == * smiles: ** C([O-])(=O)C1(CC1)[N+] * inchi key: ** InChIKey=PAJPWUMXBYXFCZ-U...")
 
(One intermediate revision by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=INOSINE INOSINE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-68 CPD-68] ==
 
* smiles:
 
* smiles:
** C(O)C1(OC(C(O)C(O)1)N3(C=NC2(C(=O)NC=NC=23)))
+
** C([O-])(=O)C1(CC1)[N+]
 
* inchi key:
 
* inchi key:
** InChIKey=UGQMRVRMYYASKQ-KQYNXXCUSA-N
+
** InChIKey=PAJPWUMXBYXFCZ-UHFFFAOYSA-N
 
* common name:
 
* common name:
** inosine
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** 1-aminocyclopropane-1-carboxylate
 
* molecular weight:
 
* molecular weight:
** 268.229    
+
** 101.105    
 
* Synonym(s):
 
* Synonym(s):
** hypoxanthine-ribose
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** 1-aminocyclopropane-1-carboxylic acid
** iso-prinosine
+
** ACC
** riboxine
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** 1-aminocyclopropanecarboxylic acid
 +
** 1-aminocyclopropanecarboxylate
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[4.1.99.4-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-7607]]
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* [[4.4.1.14-RXN]]
* [[ADENODEAMIN-RXN]]
+
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
* [[INOPHOSPHOR-RXN]]
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* [[RXN-15149]]
 
== External links  ==
 
== External links  ==
* CAS : 58-63-9
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* CAS : 22059-21-8
* BIGG : 34525
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* DRUGBANK : DB04335
+
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6021 6021]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6971063 6971063]
* HMDB : HMDB00195
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* HMDB : HMDB36458
 
* LIGAND-CPD:
 
* LIGAND-CPD:
** [http://www.genome.jp/dbget-bin/www_bget?C00294 C00294]
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** [http://www.genome.jp/dbget-bin/www_bget?C01234 C01234]
* CHEMSPIDER:
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** [http://www.chemspider.com/Chemical-Structure.5799.html 5799]
+
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17596 17596]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58360 58360]
* METABOLIGHTS : MTBLC17596
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* METABOLIGHTS : MTBLC58360
{{#set: smiles=C(O)C1(OC(C(O)C(O)1)N3(C=NC2(C(=O)NC=NC=23)))}}
+
{{#set: smiles=C([O-])(=O)C1(CC1)[N+]}}
{{#set: inchi key=InChIKey=UGQMRVRMYYASKQ-KQYNXXCUSA-N}}
+
{{#set: inchi key=InChIKey=PAJPWUMXBYXFCZ-UHFFFAOYSA-N}}
{{#set: common name=inosine}}
+
{{#set: common name=1-aminocyclopropane-1-carboxylate}}
{{#set: molecular weight=268.229   }}
+
{{#set: molecular weight=101.105   }}
{{#set: common name=hypoxanthine-ribose|iso-prinosine|riboxine}}
+
{{#set: common name=1-aminocyclopropane-1-carboxylic acid|ACC|1-aminocyclopropanecarboxylic acid|1-aminocyclopropanecarboxylate}}
{{#set: produced by=RXN-7607|ADENODEAMIN-RXN}}
+
{{#set: consumed by=4.1.99.4-RXN}}
{{#set: reversible reaction associated=INOPHOSPHOR-RXN}}
+
{{#set: produced by=4.4.1.14-RXN}}
 +
{{#set: reversible reaction associated=RXN-15149}}

Latest revision as of 20:22, 21 March 2018

Metabolite CPD-68

  • smiles:
    • C([O-])(=O)C1(CC1)[N+]
  • inchi key:
    • InChIKey=PAJPWUMXBYXFCZ-UHFFFAOYSA-N
  • common name:
    • 1-aminocyclopropane-1-carboxylate
  • molecular weight:
    • 101.105
  • Synonym(s):
    • 1-aminocyclopropane-1-carboxylic acid
    • ACC
    • 1-aminocyclopropanecarboxylic acid
    • 1-aminocyclopropanecarboxylate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 22059-21-8
  • PUBCHEM:
  • HMDB : HMDB36458
  • LIGAND-CPD:
  • CHEBI:
  • METABOLIGHTS : MTBLC58360
"C([O-])(=O)C1(CC1)[N+" cannot be used as a page name in this wiki.