Difference between revisions of "CPD-7100"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN66-23 RXN66-23] == * direction: ** LEFT-TO-RIGHT * common name: ** 3-beta hydroxysteroid dehydro...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7100 CPD-7100] == * smiles: ** CC(C(C(=O)[O-])C(=O)C(=O)[O-])C * inchi key: ** InChIKey=HII...")
 
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN66-23 RXN66-23] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7100 CPD-7100] ==
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* direction:
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* smiles:
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** LEFT-TO-RIGHT
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** CC(C(C(=O)[O-])C(=O)C(=O)[O-])C
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* inchi key:
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** InChIKey=HIIZAGQWABAMRR-BYPYZUCNSA-L
 
* common name:
 
* common name:
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** 3-beta hydroxysteroid dehydrogenase/isomerase
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** (2S)-2-isopropyl-3-oxosuccinate
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* ec number:
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* molecular weight:
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** [http://enzyme.expasy.org/EC/1.1.1.170 EC-1.1.1.170]
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** 172.137   
 
* Synonym(s):
 
* Synonym(s):
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** 2-isopropyl-3-oxosuccinate
  
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== Reaction Formula ==
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== Reaction(s) known to consume the compound ==
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* With identifiers:
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* [[RXN-7800]]
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** 1 [[NAD-P-OR-NOP]][c] '''+''' 1 [[CPD-8619]][c] '''=>''' 1 [[CPD-8620]][c] '''+''' 1 [[CARBON-DIOXIDE]][c] '''+''' 1 [[NADH-P-OR-NOP]][c]
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== Reaction(s) known to produce the compound ==
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* With common name(s):
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== Reaction(s) of unknown directionality ==
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** 1 NAD(P)+[c] '''+''' 1 4α-carboxy-5α-cholesta-8-en-3β-ol[c] '''=>''' 1 5α-cholesta-8-en-3-one[c] '''+''' 1 CO2[c] '''+''' 1 NAD(P)H[c]
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* [[3-ISOPROPYLMALDEHYDROG-RXN]]
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== Genes associated with this reaction  ==
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Genes have been associated with this reaction based on different elements listed below.
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* Gene: [[Ec-21_001850]]
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** Source: [[annotation-esiliculosus_genome]]
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*** Assignment: EC-NUMBER
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== Pathways  ==
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* [[PWY66-3]], cholesterol biosynthesis II (via 24,25-dihydrolanosterol): [http://metacyc.org/META/NEW-IMAGE?object=PWY66-3 PWY66-3]
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** '''9''' reactions found over '''22''' reactions in the full pathway
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== Reconstruction information  ==
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* Category: [[annotation]]
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** Source: [[annotation-esiliculosus_genome]]
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*** Tool: [[pathwaytools]]
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== External links  ==
 
== External links  ==
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{{#set: direction=LEFT-TO-RIGHT}}
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* LIGAND-CPD:
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{{#set: common name=3-beta hydroxysteroid dehydrogenase/isomerase}}
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** [http://www.genome.jp/dbget-bin/www_bget?C04236 C04236]
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{{#set: ec number=EC-1.1.1.170}}
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* CHEBI:
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{{#set: gene associated=Ec-21_001850}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17214 17214]
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{{#set: in pathway=PWY66-3}}
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* BIGG : 43420
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{{#set: reconstruction category=annotation}}
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* PUBCHEM:
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{{#set: reconstruction source=annotation-esiliculosus_genome}}
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6419705 6419705]
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{{#set: reconstruction tool=pathwaytools}}
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* HMDB : HMDB12149
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{{#set: smiles=CC(C(C(=O)[O-])C(=O)C(=O)[O-])C}}
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{{#set: inchi key=InChIKey=HIIZAGQWABAMRR-BYPYZUCNSA-L}}
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{{#set: common name=(2S)-2-isopropyl-3-oxosuccinate}}
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{{#set: molecular weight=172.137    }}
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{{#set: common name=2-isopropyl-3-oxosuccinate}}
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{{#set: consumed by=RXN-7800}}
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{{#set: reversible reaction associated=3-ISOPROPYLMALDEHYDROG-RXN}}

Latest revision as of 20:55, 21 March 2018

Metabolite CPD-7100

  • smiles:
    • CC(C(C(=O)[O-])C(=O)C(=O)[O-])C
  • inchi key:
    • InChIKey=HIIZAGQWABAMRR-BYPYZUCNSA-L
  • common name:
    • (2S)-2-isopropyl-3-oxosuccinate
  • molecular weight:
    • 172.137
  • Synonym(s):
    • 2-isopropyl-3-oxosuccinate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

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




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