Difference between revisions of "CPD-4578"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3-P-HYDROXYPYRUVATE 3-P-HYDROXYPYRUVATE] == * smiles: ** C(OP([O-])(=O)[O-])C(=O)C(=O)[O-] * in...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-4578 CPD-4578] == * smiles: ** CC(C)=CCCC(C)[CH]3(CC[CH]4(C2(CC[CH]1(C(C)C(=O)CCC(C)1C=2CCC...")
 
(One intermediate revision by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3-P-HYDROXYPYRUVATE 3-P-HYDROXYPYRUVATE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-4578 CPD-4578] ==
 
* smiles:
 
* smiles:
−
** C(OP([O-])(=O)[O-])C(=O)C(=O)[O-]
+
** CC(C)=CCCC(C)[CH]3(CC[CH]4(C2(CC[CH]1(C(C)C(=O)CCC(C)1C=2CCC(C)34))))
 
* inchi key:
 
* inchi key:
−
** InChIKey=LFLUCDOSQPJJBE-UHFFFAOYSA-K
+
** InChIKey=DBPZYKHQDWKORQ-SINUOACOSA-N
 
* common name:
 
* common name:
−
** 3-phospho-hydroxypyruvate
+
** 3-dehydro-4-methylzymosterol
 
* molecular weight:
 
* molecular weight:
−
** 181.018    
+
** 396.655    
 
* Synonym(s):
 
* Synonym(s):
−
** phosphohydroxypyruvate
+
** 4α-methyl-5α-cholesta-8,24-dien-3-one
−
** 3-phosphonooxypyruvate
+
** 3-keto-4-methylzymosterol
−
** 3-P-hydroxypyruvate
+
−
** 3-p-OH-pyr
+
−
** 3-phosphohydroxypyruvate
+
−
** 3-p-OH-pyruvate
+
−
** 3-p-hydroxy-pyr
+
−
** 3-phosphohydroxy-pyr
+
−
** phosphohydroxypyruate
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN66-313]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[PSERTRANSAM-RXN]]
 
−
* [[PGLYCDEHYDROG-RXN]]
 
 
== External links  ==
 
== External links  ==
−
* CAS : 3913-50-6
 
−
* BIGG : 41453
 
−
* PUBCHEM:
 
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5460375 5460375]
 
−
* HMDB : HMDB01024
 
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C03232 C03232]
+
** [http://www.genome.jp/dbget-bin/www_bget?C15816 C15816]
−
* CHEMSPIDER:
+
−
** [http://www.chemspider.com/Chemical-Structure.4573923.html 4573923]
+
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=18110 18110]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=50593 50593]
−
* METABOLIGHTS : MTBLC18110
+
* METABOLIGHTS : MTBLC50593
−
{{#set: smiles=C(OP([O-])(=O)[O-])C(=O)C(=O)[O-]}}
+
* PUBCHEM:
−
{{#set: inchi key=InChIKey=LFLUCDOSQPJJBE-UHFFFAOYSA-K}}
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=22298939 22298939]
−
{{#set: common name=3-phospho-hydroxypyruvate}}
+
* HMDB : HMDB06838
−
{{#set: molecular weight=181.018   }}
+
{{#set: smiles=CC(C)=CCCC(C)[CH]3(CC[CH]4(C2(CC[CH]1(C(C)C(=O)CCC(C)1C=2CCC(C)34))))}}
−
{{#set: common name=phosphohydroxypyruvate|3-phosphonooxypyruvate|3-P-hydroxypyruvate|3-p-OH-pyr|3-phosphohydroxypyruvate|3-p-OH-pyruvate|3-p-hydroxy-pyr|3-phosphohydroxy-pyr|phosphohydroxypyruate}}
+
{{#set: inchi key=InChIKey=DBPZYKHQDWKORQ-SINUOACOSA-N}}
−
{{#set: reversible reaction associated=PSERTRANSAM-RXN|PGLYCDEHYDROG-RXN}}
+
{{#set: common name=3-dehydro-4-methylzymosterol}}
 +
{{#set: molecular weight=396.655   }}
 +
{{#set: common name=4α-methyl-5α-cholesta-8,24-dien-3-one|3-keto-4-methylzymosterol}}
 +
{{#set: produced by=RXN66-313}}

Latest revision as of 19:57, 21 March 2018

Metabolite CPD-4578

  • smiles:
    • CC(C)=CCCC(C)[CH]3(CC[CH]4(C2(CC[CH]1(C(C)C(=O)CCC(C)1C=2CCC(C)34))))
  • inchi key:
    • InChIKey=DBPZYKHQDWKORQ-SINUOACOSA-N
  • common name:
    • 3-dehydro-4-methylzymosterol
  • molecular weight:
    • 396.655
  • Synonym(s):
    • 4α-methyl-5α-cholesta-8,24-dien-3-one
    • 3-keto-4-methylzymosterol

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • LIGAND-CPD:
  • CHEBI:
  • METABOLIGHTS : MTBLC50593
  • PUBCHEM:
  • HMDB : HMDB06838
"CC(C)=CCCC(C)[CH]3(CC[CH]4(C2(CC[CH]1(C(C)C(=O)CCC(C)1C=2CCC(C)34))))" cannot be used as a page name in this wiki.



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