Difference between revisions of "CARBOXYMETHYL-HYDROXYPHENYLPROPCOA"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-14272 RXN-14272] == * direction: ** LEFT-TO-RIGHT * common name: ** (E)-hexadec-2-enoyl-CoA hyd...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CARBOXYMETHYL-HYDROXYPHENYLPROPCOA CARBOXYMETHYL-HYDROXYPHENYLPROPCOA] == * smiles: ** CC(C)(C(...")
 
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-14272 RXN-14272] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CARBOXYMETHYL-HYDROXYPHENYLPROPCOA CARBOXYMETHYL-HYDROXYPHENYLPROPCOA] ==
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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)C(=O)NCCC(=O)NCCSC(C(CC([O-])=O)C(O)C1(=CC=CC=C1))=O)COP(=O)(OP(=O)(OCC2(C(OP([O-])(=O)[O-])C(O)C(O2)N4(C3(=C(C(N)=NC=N3)N=C4))))[O-])[O-]
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* inchi key:
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** InChIKey=DVSQFPLMOLPRDU-ACXVELPGSA-I
 
* common name:
 
* common name:
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** (E)-hexadec-2-enoyl-CoA hydratase
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** 2-carboxymethyl-3-hydroxyphenylpropanoyl-CoA
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** Beta-hydroxydecanoyl thiol ester dehydrase, FabA/FabZ
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* molecular weight:
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** ClpP/crotonase-like domain
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** 968.692   
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** enoyl-Coenzyme A hydratase/3-hydroxyacyl Coenzyme A dehydrogenase
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* ec number:
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** [http://enzyme.expasy.org/EC/4.2.1.17 EC-4.2.1.17]
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* Synonym(s):
 
* Synonym(s):
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** (hydroxymethylphenyl)succinyl-CoA
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** 2-carboxymethyl-3-hydroxyphenylpropionyl-CoA
  
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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-905]]
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** 1 [[CPD0-2117]][c] '''+''' 1 [[WATER]][c] '''=>''' 1 [[CPD0-2232]][c]
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== Reaction(s) known to produce the compound ==
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* With common name(s):
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* [[RXN-902]]
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** 1 trans-hexadec-2-enoyl-CoA[c] '''+''' 1 H2O[c] '''=>''' 1 (S)-3-hydroxyhexadecanoyl-CoA[c]
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== Reaction(s) of unknown directionality ==
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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-16_003560]]
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** Source: [[annotation-esiliculosus_genome]]
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*** Assignment: EC-NUMBER
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* Gene: [[Ec-16_001250]]
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** Source: [[annotation-esiliculosus_genome]]
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*** Assignment: EC-NUMBER
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* Gene: [[Ec-06_001380]]
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** Source: [[annotation-esiliculosus_genome]]
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*** Assignment: EC-NUMBER
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* Gene: [[Ec-14_006530]]
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** Source: [[annotation-esiliculosus_genome]]
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*** Assignment: AUTOMATED-NAME-MATCH
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== Pathways  ==
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* [[PWY-7654]], (8E,10E)-dodeca-8,10-dienol biosynthesis: [http://metacyc.org/META/NEW-IMAGE?object=PWY-7654 PWY-7654]
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** '''5''' reactions found over '''11''' reactions in the full pathway
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* [[PWY-7656]], Spodoptera littoralis pheromone biosynthesis: [http://metacyc.org/META/NEW-IMAGE?object=PWY-7656 PWY-7656]
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** '''4''' 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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* RHEA:
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* PUBCHEM:
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** [http://www.ebi.ac.uk/rhea/reaction.xhtml?id=31165 31165]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90658758 90658758]
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* LIGAND-RXN:
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* CHEBI:
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** [http://www.genome.jp/dbget-bin/www_bget?R04738 R04738]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=28202 28202]
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{{#set: direction=LEFT-TO-RIGHT}}
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* LIGAND-CPD:
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{{#set: common name=(E)-hexadec-2-enoyl-CoA hydratase}}
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** [http://www.genome.jp/dbget-bin/www_bget?C09819 C09819]
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{{#set: common name=Beta-hydroxydecanoyl thiol ester dehydrase, FabA/FabZ}}
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* HMDB : HMDB12145
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{{#set: common name=ClpP/crotonase-like domain}}
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{{#set: smiles=CC(C)(C(O)C(=O)NCCC(=O)NCCSC(C(CC([O-])=O)C(O)C1(=CC=CC=C1))=O)COP(=O)(OP(=O)(OCC2(C(OP([O-])(=O)[O-])C(O)C(O2)N4(C3(=C(C(N)=NC=N3)N=C4))))[O-])[O-]}}
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{{#set: common name=enoyl-Coenzyme A hydratase/3-hydroxyacyl Coenzyme A dehydrogenase}}
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{{#set: inchi key=InChIKey=DVSQFPLMOLPRDU-ACXVELPGSA-I}}
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{{#set: ec number=EC-4.2.1.17}}
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{{#set: common name=2-carboxymethyl-3-hydroxyphenylpropanoyl-CoA}}
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{{#set: gene associated=Ec-16_003560|Ec-16_001250|Ec-06_001380|Ec-14_006530}}
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{{#set: molecular weight=968.692    }}
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{{#set: in pathway=PWY-7654|PWY-7656}}
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{{#set: common name=(hydroxymethylphenyl)succinyl-CoA|2-carboxymethyl-3-hydroxyphenylpropionyl-CoA}}
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{{#set: reconstruction category=annotation}}
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{{#set: consumed by=RXN-905}}
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{{#set: reconstruction source=annotation-esiliculosus_genome}}
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{{#set: produced by=RXN-902}}
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{{#set: reconstruction tool=pathwaytools}}
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Latest revision as of 19:52, 21 March 2018

Metabolite CARBOXYMETHYL-HYDROXYPHENYLPROPCOA

  • smiles:
    • CC(C)(C(O)C(=O)NCCC(=O)NCCSC(C(CC([O-])=O)C(O)C1(=CC=CC=C1))=O)COP(=O)(OP(=O)(OCC2(C(OP([O-])(=O)[O-])C(O)C(O2)N4(C3(=C(C(N)=NC=N3)N=C4))))[O-])[O-]
  • inchi key:
    • InChIKey=DVSQFPLMOLPRDU-ACXVELPGSA-I
  • common name:
    • 2-carboxymethyl-3-hydroxyphenylpropanoyl-CoA
  • molecular weight:
    • 968.692
  • Synonym(s):
    • (hydroxymethylphenyl)succinyl-CoA
    • 2-carboxymethyl-3-hydroxyphenylpropionyl-CoA

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)C(=O)NCCC(=O)NCCSC(C(CC([O-])=O)C(O)C1(=CC=CC=C1))=O)COP(=O)(OP(=O)(OCC2(C(OP([O-])(=O)[O-])C(O)C(O2)N4(C3(=C(C(N)=NC=N3)N=C4))))[O-])[O-" cannot be used as a page name in this wiki.




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