Difference between revisions of "2-D-THREO-HYDROXY-3-CARBOXY-ISOCAPROATE"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=2-D-THREO-HYDROXY-3-CARBOXY-ISOCAPROATE 2-D-THREO-HYDROXY-3-CARBOXY-ISOCAPROATE] == * smiles: *...")
 
Line 3: Line 3:
 
* smiles:
 
* smiles:
 
** CC(C)C(C([O-])=O)C(C([O-])=O)O
 
** CC(C)C(C([O-])=O)C(C([O-])=O)O
 +
* molecular weight:
 +
** 174.153   
 
* inchi key:
 
* inchi key:
 
** InChIKey=RNQHMTFBUSSBJQ-CRCLSJGQSA-L
 
** InChIKey=RNQHMTFBUSSBJQ-CRCLSJGQSA-L
 
* common name:
 
* common name:
 
** (2R,3S)-3-isopropylmalate
 
** (2R,3S)-3-isopropylmalate
−
* molecular weight:
 
−
** 174.153   
 
 
* Synonym(s):
 
* Synonym(s):
 
** 2-D-threo-hydroxy-3-carboxy-isocaproate
 
** 2-D-threo-hydroxy-3-carboxy-isocaproate
Line 19: Line 19:
 
== 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-8991]]
+
* [[3-ISOPROPYLMALDEHYDROG-RXN]]
 
* [[RXN-13163]]
 
* [[RXN-13163]]
−
* [[3-ISOPROPYLMALDEHYDROG-RXN]]
+
* [[RXN-8991]]
 
== External links  ==
 
== External links  ==
−
* PUBCHEM:
+
* BIGG : 3c2hmp
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6857402 6857402]
+
−
* HMDB : HMDB12156
+
 
* LIGAND-CPD:
 
* LIGAND-CPD:
 
** [http://www.genome.jp/dbget-bin/www_bget?C04411 C04411]
 
** [http://www.genome.jp/dbget-bin/www_bget?C04411 C04411]
 +
* HMDB : HMDB12156
 
* CHEMSPIDER:
 
* CHEMSPIDER:
 
** [http://www.chemspider.com/Chemical-Structure.5256741.html 5256741]
 
** [http://www.chemspider.com/Chemical-Structure.5256741.html 5256741]
 
* CHEBI:
 
* CHEBI:
 
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=35121 35121]
 
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=35121 35121]
−
* BIGG : 3c2hmp
+
* PUBCHEM:
 +
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6857402 6857402]
 
{{#set: smiles=CC(C)C(C([O-])=O)C(C([O-])=O)O}}
 
{{#set: smiles=CC(C)C(C([O-])=O)C(C([O-])=O)O}}
 +
{{#set: molecular weight=174.153    }}
 
{{#set: inchi key=InChIKey=RNQHMTFBUSSBJQ-CRCLSJGQSA-L}}
 
{{#set: inchi key=InChIKey=RNQHMTFBUSSBJQ-CRCLSJGQSA-L}}
 
{{#set: common name=(2R,3S)-3-isopropylmalate}}
 
{{#set: common name=(2R,3S)-3-isopropylmalate}}
−
{{#set: molecular weight=174.153    }}
 
 
{{#set: common name=2-D-threo-hydroxy-3-carboxy-isocaproate|3-carboxy-2-hydroxy-4-methylpentanoate|β-isopropylmalate|3-isopropylmalate}}
 
{{#set: common name=2-D-threo-hydroxy-3-carboxy-isocaproate|3-carboxy-2-hydroxy-4-methylpentanoate|β-isopropylmalate|3-isopropylmalate}}
 
{{#set: consumed by=RXN-13158}}
 
{{#set: consumed by=RXN-13158}}
−
{{#set: reversible reaction associated=RXN-8991|RXN-13163|3-ISOPROPYLMALDEHYDROG-RXN}}
+
{{#set: reversible reaction associated=3-ISOPROPYLMALDEHYDROG-RXN|RXN-13163|RXN-8991}}

Latest revision as of 16:16, 9 January 2019

Metabolite 2-D-THREO-HYDROXY-3-CARBOXY-ISOCAPROATE

  • smiles:
    • CC(C)C(C([O-])=O)C(C([O-])=O)O
  • molecular weight:
    • 174.153
  • inchi key:
    • InChIKey=RNQHMTFBUSSBJQ-CRCLSJGQSA-L
  • common name:
    • (2R,3S)-3-isopropylmalate
  • Synonym(s):
    • 2-D-threo-hydroxy-3-carboxy-isocaproate
    • 3-carboxy-2-hydroxy-4-methylpentanoate
    • β-isopropylmalate
    • 3-isopropylmalate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

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




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