Difference between revisions of "RXN66-313"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-8609 CPD-8609] == * smiles: ** CC(C)CCCC([CH]4(C1(C)(C(C2(=C(CC1)C3(C)([CH](CC2)C(C)(C)C(O)...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=IMINOASPARTATE IMINOASPARTATE] == * smiles: ** C(=O)([O-])CC(=N)C(=O)[O-] * inchi key: ** InChI...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-8609 CPD-8609] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=IMINOASPARTATE IMINOASPARTATE] ==
 
* smiles:
 
* smiles:
** CC(C)CCCC([CH]4(C1(C)(C(C2(=C(CC1)C3(C)([CH](CC2)C(C)(C)C(O)CC3)))=CC4)))C
+
** C(=O)([O-])CC(=N)C(=O)[O-]
 
* inchi key:
 
* inchi key:
** InChIKey=OGQJUYXFIOFTMA-PBJLWWPKSA-N
+
** InChIKey=NMUOATVLLQEYHI-UHFFFAOYSA-L
 
* common name:
 
* common name:
** 4,4-dimethyl-5-α-cholesta-8,14-dien-3-β-ol
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** 2-iminosuccinate
 
* molecular weight:
 
* molecular weight:
** 412.698    
+
** 129.072    
 
* Synonym(s):
 
* Synonym(s):
 +
** 2-iminobutanedioate
 +
** α-iminosuccinate
 +
** iminoaspartate
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN66-14]]
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* [[QUINOLINATE-SYNTHA-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN66-13]]
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* [[L-ASPARTATE-OXID-RXN]]
* [[RXN-13707]]
+
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25200473 25200473]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=23615393 23615393]
{{#set: smiles=CC(C)CCCC([CH]4(C1(C)(C(C2(=C(CC1)C3(C)([CH](CC2)C(C)(C)C(O)CC3)))=CC4)))C}}
+
* HMDB : HMDB01131
{{#set: inchi key=InChIKey=OGQJUYXFIOFTMA-PBJLWWPKSA-N}}
+
* LIGAND-CPD:
{{#set: common name=4,4-dimethyl-5-α-cholesta-8,14-dien-3-β-ol}}
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** [http://www.genome.jp/dbget-bin/www_bget?C05840 C05840]
{{#set: molecular weight=412.698   }}
+
* CHEMSPIDER:
{{#set: consumed by=RXN66-14}}
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** [http://www.chemspider.com/Chemical-Structure.19951415.html 19951415]
{{#set: produced by=RXN66-13|RXN-13707}}
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* CHEBI:
 +
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58831 58831]
 +
* BIGG : 46611
 +
{{#set: smiles=C(=O)([O-])CC(=N)C(=O)[O-]}}
 +
{{#set: inchi key=InChIKey=NMUOATVLLQEYHI-UHFFFAOYSA-L}}
 +
{{#set: common name=2-iminosuccinate}}
 +
{{#set: molecular weight=129.072   }}
 +
{{#set: common name=2-iminobutanedioate|α-iminosuccinate|iminoaspartate}}
 +
{{#set: consumed by=QUINOLINATE-SYNTHA-RXN}}
 +
{{#set: produced by=L-ASPARTATE-OXID-RXN}}

Revision as of 13:29, 21 March 2018

Metabolite IMINOASPARTATE

  • smiles:
    • C(=O)([O-])CC(=N)C(=O)[O-]
  • inchi key:
    • InChIKey=NMUOATVLLQEYHI-UHFFFAOYSA-L
  • common name:
    • 2-iminosuccinate
  • molecular weight:
    • 129.072
  • Synonym(s):
    • 2-iminobutanedioate
    • α-iminosuccinate
    • iminoaspartate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

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