Difference between revisions of "3-UREIDO-ISOBUTYRATE"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CH33ADO CH33ADO] == * smiles: ** CC1(C(O)C(O)C(O1)N3(C=NC2(C(N)=NC=NC=23))) * inchi key: ** InC...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3-UREIDO-ISOBUTYRATE 3-UREIDO-ISOBUTYRATE] == * smiles: ** CC(CNC(N)=O)C(=O)[O-] * inchi key: *...")
 
(2 intermediate revisions by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CH33ADO CH33ADO] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3-UREIDO-ISOBUTYRATE 3-UREIDO-ISOBUTYRATE] ==
 
* smiles:
 
* smiles:
** CC1(C(O)C(O)C(O1)N3(C=NC2(C(N)=NC=NC=23)))
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** CC(CNC(N)=O)C(=O)[O-]
 
* inchi key:
 
* inchi key:
** InChIKey=XGYIMTFOTBMPFP-KQYNXXCUSA-N
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** InChIKey=PHENTZNALBMCQD-GSVOUGTGSA-M
 
* common name:
 
* common name:
** 5'-deoxyadenosine
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** (R)-3-ureido-isobutanoate
 
* molecular weight:
 
* molecular weight:
** 251.244    
+
** 145.138    
 
* Synonym(s):
 
* Synonym(s):
** CH3Ado
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** N-carbamyl-β-aminoisobutyric acid
 +
** N-carbamyl-β-aminoisobutyrate
 +
** (R)-3-ureido-isobutyrate
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-11210]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[HEMN-RXN]]
 
* [[RXN0-5063]]
 
* [[2.8.1.6-RXN]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
* [[RXN-14480]]
 
* [[RXN-17473]]
 
* [[RXN-17472]]
 
 
== External links  ==
 
== External links  ==
* BIGG : 45324
 
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=439182 439182]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=91820371 91820371]
* HMDB : HMDB01983
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* LIGAND-CPD:
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** [http://www.genome.jp/dbget-bin/www_bget?C05198 C05198]
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* CHEMSPIDER:
 
* CHEMSPIDER:
** [http://www.chemspider.com/Chemical-Structure.388325.html 388325]
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** [http://www.chemspider.com/Chemical-Structure.19988990.html 19988990]
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17319 17319]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=74414 74414]
* METABOLIGHTS : MTBLC17319
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* LIGAND-CPD:
{{#set: smiles=CC1(C(O)C(O)C(O1)N3(C=NC2(C(N)=NC=NC=23)))}}
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** [http://www.genome.jp/dbget-bin/www_bget?C05100 C05100]
{{#set: inchi key=InChIKey=XGYIMTFOTBMPFP-KQYNXXCUSA-N}}
+
* HMDB : HMDB02031
{{#set: common name=5'-deoxyadenosine}}
+
{{#set: smiles=CC(CNC(N)=O)C(=O)[O-]}}
{{#set: molecular weight=251.244   }}
+
{{#set: inchi key=InChIKey=PHENTZNALBMCQD-GSVOUGTGSA-M}}
{{#set: common name=CH3Ado}}
+
{{#set: common name=(R)-3-ureido-isobutanoate}}
{{#set: produced by=HEMN-RXN|RXN0-5063|2.8.1.6-RXN}}
+
{{#set: molecular weight=145.138   }}
{{#set: consumed or produced by=RXN-14480|RXN-17473|RXN-17472}}
+
{{#set: common name=N-carbamyl-β-aminoisobutyric acid|N-carbamyl-β-aminoisobutyrate|(R)-3-ureido-isobutyrate}}
 +
{{#set: consumed by=RXN-11210}}

Latest revision as of 20:42, 21 March 2018

Metabolite 3-UREIDO-ISOBUTYRATE

  • smiles:
    • CC(CNC(N)=O)C(=O)[O-]
  • inchi key:
    • InChIKey=PHENTZNALBMCQD-GSVOUGTGSA-M
  • common name:
    • (R)-3-ureido-isobutanoate
  • molecular weight:
    • 145.138
  • Synonym(s):
    • N-carbamyl-β-aminoisobutyric acid
    • N-carbamyl-β-aminoisobutyrate
    • (R)-3-ureido-isobutyrate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CC(CNC(N)=O)C(=O)[O-" cannot be used as a page name in this wiki.