Difference between revisions of "TRIMETHYLSULFONIUM"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=23-DIPHOSPHOGLYCERATE 23-DIPHOSPHOGLYCERATE] == * smiles: ** C(OP(=O)([O-])[O-])C(OP(=O)([O-])[...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=BENZENE-NO2 BENZENE-NO2] == * smiles: ** C1(=CC=C(C=C1)[N+]([O-])=O) * inchi key: ** InChIKey=L...")
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=23-DIPHOSPHOGLYCERATE 23-DIPHOSPHOGLYCERATE] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=BENZENE-NO2 BENZENE-NO2] ==
 
* smiles:
 
* smiles:
** C(OP(=O)([O-])[O-])C(OP(=O)([O-])[O-])C(=O)[O-]
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** C1(=CC=C(C=C1)[N+]([O-])=O)
 
* inchi key:
 
* inchi key:
** InChIKey=XOHUEYCVLUUEJJ-UWTATZPHSA-I
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** InChIKey=LQNUZADURLCDLV-UHFFFAOYSA-N
 
* common name:
 
* common name:
** 2,3-diphospho-D-glycerate
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** nitrobenzene
 
* molecular weight:
 
* molecular weight:
** 260.998    
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** 123.111    
 
* Synonym(s):
 
* Synonym(s):
** 2,3-bisphosphoglycerate
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** benzene-NO2
** D-Greenwald ester
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** nitro-benzene
** 2,3-P2-D-glycerate
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** 2,3-bisphospho-D-glycerate
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** 2,3-diphosphoglycerate
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** DPG
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** 2,3-bisPGA
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== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-3661]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
* [[RXN-15512]]
 
* [[RXN-15509]]
 
* [[RXN-15510]]
 
* [[RXN-15511]]
 
 
== External links  ==
 
== External links  ==
 +
* CAS : 98-95-3
 +
* PUBCHEM:
 +
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=7416 7416]
 +
* HMDB : HMDB41950
 
* LIGAND-CPD:
 
* LIGAND-CPD:
** [http://www.genome.jp/dbget-bin/www_bget?C01159 C01159]
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** [http://www.genome.jp/dbget-bin/www_bget?C06813 C06813]
 +
* CHEMSPIDER:
 +
** [http://www.chemspider.com/Chemical-Structure.7138.html 7138]
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58248 58248]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=27798 27798]
* METABOLIGHTS : MTBLC58248
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{{#set: smiles=C1(=CC=C(C=C1)[N+]([O-])=O)}}
* PUBCHEM:
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{{#set: inchi key=InChIKey=LQNUZADURLCDLV-UHFFFAOYSA-N}}
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25200383 25200383]
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{{#set: common name=nitrobenzene}}
* HMDB : HMDB01294
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{{#set: molecular weight=123.111   }}
{{#set: smiles=C(OP(=O)([O-])[O-])C(OP(=O)([O-])[O-])C(=O)[O-]}}
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{{#set: common name=benzene-NO2|nitro-benzene}}
{{#set: inchi key=InChIKey=XOHUEYCVLUUEJJ-UWTATZPHSA-I}}
+
{{#set: consumed by=RXN-3661}}
{{#set: common name=2,3-diphospho-D-glycerate}}
+
{{#set: molecular weight=260.998   }}
+
{{#set: common name=2,3-bisphosphoglycerate|D-Greenwald ester|2,3-P2-D-glycerate|2,3-bisphospho-D-glycerate|2,3-diphosphoglycerate|DPG|2,3-bisPGA}}
+
{{#set: reversible reaction associated=RXN-15512|RXN-15509|RXN-15510|RXN-15511}}
+

Revision as of 13:58, 21 March 2018

Metabolite BENZENE-NO2

  • smiles:
    • C1(=CC=C(C=C1)[N+]([O-])=O)
  • inchi key:
    • InChIKey=LQNUZADURLCDLV-UHFFFAOYSA-N
  • common name:
    • nitrobenzene
  • molecular weight:
    • 123.111
  • Synonym(s):
    • benzene-NO2
    • nitro-benzene

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 98-95-3
  • PUBCHEM:
  • HMDB : HMDB41950
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
"C1(=CC=C(C=C1)[N+]([O-])=O)" cannot be used as a page name in this wiki.