Difference between revisions of "ACRYLATE"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=2-METHYL-3-PHYTYL-14-NAPHTHOQUINONE 2-METHYL-3-PHYTYL-14-NAPHTHOQUINONE] == * smiles: ** CC(C)C...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ACRYLATE ACRYLATE] == * smiles: ** C=CC([O-])=O * common name: ** acrylate * inchi key: ** InCh...")
 
(3 intermediate revisions by the same user not shown)
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=2-METHYL-3-PHYTYL-14-NAPHTHOQUINONE 2-METHYL-3-PHYTYL-14-NAPHTHOQUINONE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ACRYLATE ACRYLATE] ==
 
* smiles:
 
* smiles:
−
** CC(C)CCCC(C)CCCC(C)CCCC(C)=CCC2(=C(C(=O)C1(C=CC=CC=1C2=O))C)
+
** C=CC([O-])=O
−
* inchi key:
+
−
** InChIKey=MBWXNTAXLNYFJB-LKUDQCMESA-N
+
 
* common name:
 
* common name:
−
** phylloquinone
+
** acrylate
 +
* inchi key:
 +
** InChIKey=NIXOWILDQLNWCW-UHFFFAOYSA-M
 
* molecular weight:
 
* molecular weight:
−
** 450.703    
+
** 71.055    
 
* Synonym(s):
 
* Synonym(s):
−
** 2-methyl-3-phytyl-1,4-naphthoquinone
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** acrylic acid
−
** phytonadione
+
−
** phytomenadione
+
−
** 3-phytylmenadione
+
−
** vitamin K1
+
  
 
== 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 ==
−
* [[R06859]]
+
* [[R311-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[1.1.4.1-RXN]]
 
 
== External links  ==
 
== External links  ==
−
* NCI:
+
* UM-BBD-CPD : c0113
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** [http://cactus.nci.nih.gov/ncidb2.2/?nsc=270681 270681]
+
−
* CAS : 84-80-0
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−
* Wikipedia : Phylloquinone
+
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5280483 5280483]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25188 25188]
−
* HMDB : HMDB03555
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* HMDB : HMDB31647
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C02059 C02059]
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** [http://www.genome.jp/dbget-bin/www_bget?C00511 C00511]
 
* CHEMSPIDER:
 
* CHEMSPIDER:
−
** [http://www.chemspider.com/Chemical-Structure.4444124.html 4444124]
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** [http://www.chemspider.com/Chemical-Structure.23524.html 23524]
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=583972 583972]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=37080 37080]
−
{{#set: smiles=CC(C)CCCC(C)CCCC(C)CCCC(C)=CCC2(=C(C(=O)C1(C=CC=CC=1C2=O))C)}}
+
* METABOLIGHTS : MTBLC37080
−
{{#set: inchi key=InChIKey=MBWXNTAXLNYFJB-LKUDQCMESA-N}}
+
{{#set: smiles=C=CC([O-])=O}}
−
{{#set: common name=phylloquinone}}
+
{{#set: common name=acrylate}}
−
{{#set: molecular weight=450.703   }}
+
{{#set: inchi key=InChIKey=NIXOWILDQLNWCW-UHFFFAOYSA-M}}
−
{{#set: common name=2-methyl-3-phytyl-1,4-naphthoquinone|phytonadione|phytomenadione|3-phytylmenadione|vitamin K1}}
+
{{#set: molecular weight=71.055   }}
−
{{#set: produced by=R06859}}
+
{{#set: common name=acrylic acid}}
−
{{#set: consumed or produced by=1.1.4.1-RXN}}
+
{{#set: produced by=R311-RXN}}

Latest revision as of 19:13, 21 March 2018

Metabolite ACRYLATE

  • smiles:
    • C=CC([O-])=O
  • common name:
    • acrylate
  • inchi key:
    • InChIKey=NIXOWILDQLNWCW-UHFFFAOYSA-M
  • molecular weight:
    • 71.055
  • Synonym(s):
    • acrylic acid

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • UM-BBD-CPD : c0113
  • PUBCHEM:
  • HMDB : HMDB31647
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC37080
"C=CC([O-])=O" cannot be used as a page name in this wiki.



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