Difference between revisions of "4-HYDROXYBENZALDEHYDE"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=MONO-VINYL-PROTOCHLOROPHYLLIDE-A MONO-VINYL-PROTOCHLOROPHYLLIDE-A] == * smiles: ** C=CC2(C(C)=C...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CONIFERYL-ALDEHYDE CONIFERYL-ALDEHYDE] == * smiles: ** COC1(=CC(C=CC=O)=CC=C(O)1) * inchi key:...")
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=MONO-VINYL-PROTOCHLOROPHYLLIDE-A MONO-VINYL-PROTOCHLOROPHYLLIDE-A] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CONIFERYL-ALDEHYDE CONIFERYL-ALDEHYDE] ==
 
* smiles:
 
* smiles:
−
** C=CC2(C(C)=C4(C=C9(C(C)=C(CCC(=O)[O-])C5(=N([Mg]36(N1(=C(C(CC)=C(C)C1=CC=2N34)C=C7(C(C)=C8(C(=O)[C-](C(OC)=O)C5=C(N67)8)))))9))))
+
** COC1(=CC(C=CC=O)=CC=C(O)1)
 +
* inchi key:
 +
** InChIKey=DKZBBWMURDFHNE-NSCUHMNNSA-N
 
* common name:
 
* common name:
−
** protochlorophyllide a
+
** coniferaldehyde
 
* molecular weight:
 
* molecular weight:
−
** 610.951    
+
** 178.187    
 
* Synonym(s):
 
* Synonym(s):
−
** monovinyl protochlorophyllide a
+
** 4-hydroxy-3-methoxycinnamaldehyde
 +
** 4-hydroxy-3-methoxycinnamic aldehyde
 +
** coniferyl aldehyde
  
 
== 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 ==
 +
* [[RXN-1106]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[RXN1F-10]]
 
 
== External links  ==
 
== External links  ==
−
* CAS : 14751-08-7
+
* CAS : 458-36-6
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=54749448 54749448]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5280536 5280536]
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* CHEBI:
+
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57855 57855]
+
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C02880 C02880]
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** [http://www.genome.jp/dbget-bin/www_bget?C02666 C02666]
−
* HMDB : HMDB31148
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* CHEMSPIDER:
−
{{#set: smiles=C=CC2(C(C)=C4(C=C9(C(C)=C(CCC(=O)[O-])C5(=N([Mg]36(N1(=C(C(CC)=C(C)C1=CC=2N34)C=C7(C(C)=C8(C(=O)[C-](C(OC)=O)C5=C(N67)8)))))9))))}}
+
** [http://www.chemspider.com/Chemical-Structure.4444167.html 4444167]
−
{{#set: common name=protochlorophyllide a}}
+
* CHEBI:
−
{{#set: molecular weight=610.951   }}
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16547 16547]
−
{{#set: common name=monovinyl protochlorophyllide a}}
+
* METABOLIGHTS : MTBLC16547
−
{{#set: consumed or produced by=RXN1F-10}}
+
{{#set: smiles=COC1(=CC(C=CC=O)=CC=C(O)1)}}
 +
{{#set: inchi key=InChIKey=DKZBBWMURDFHNE-NSCUHMNNSA-N}}
 +
{{#set: common name=coniferaldehyde}}
 +
{{#set: molecular weight=178.187   }}
 +
{{#set: common name=4-hydroxy-3-methoxycinnamaldehyde|4-hydroxy-3-methoxycinnamic aldehyde|coniferyl aldehyde}}
 +
{{#set: produced by=RXN-1106}}

Revision as of 20:39, 17 March 2018

Metabolite CONIFERYL-ALDEHYDE

  • smiles:
    • COC1(=CC(C=CC=O)=CC=C(O)1)
  • inchi key:
    • InChIKey=DKZBBWMURDFHNE-NSCUHMNNSA-N
  • common name:
    • coniferaldehyde
  • molecular weight:
    • 178.187
  • Synonym(s):
    • 4-hydroxy-3-methoxycinnamaldehyde
    • 4-hydroxy-3-methoxycinnamic aldehyde
    • coniferyl aldehyde

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links




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