Difference between revisions of "5-HYDROXY-CONIFERALDEHYDE"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-8613 CPD-8613] == * smiles: ** CC(C)CCCC([CH]4(C1(C)([CH](C2(=C(CC1)C3(C)([CH](CC2)C(C)(C([...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=5-HYDROXY-CONIFERALDEHYDE 5-HYDROXY-CONIFERALDEHYDE] == * smiles: ** COC1(=CC(C=CC=O)=CC(O)=C(O...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-8613 CPD-8613] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=5-HYDROXY-CONIFERALDEHYDE 5-HYDROXY-CONIFERALDEHYDE] ==
 
* smiles:
 
* smiles:
** CC(C)CCCC([CH]4(C1(C)([CH](C2(=C(CC1)C3(C)([CH](CC2)C(C)(C([O-])=O)C(O)CC3)))CC4)))C
+
** COC1(=CC(C=CC=O)=CC(O)=C(O)1)
 
* inchi key:
 
* inchi key:
** InChIKey=GLCDBDRQLZKKOJ-LJAIZBFVSA-M
+
** InChIKey=IEHPLRVWOHZKCS-NSCUHMNNSA-N
 
* common name:
 
* common name:
** 4α-carboxy-4β-methyl-5α-cholesta-8-en-3β-ol
+
** 5-hydroxy-coniferaldehyde
 
* molecular weight:
 
* molecular weight:
** 443.688    
+
** 194.187    
 
* Synonym(s):
 
* Synonym(s):
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN66-18]]
+
* [[RXN-1143]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=91826592 91826592]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5282094 5282094]
 +
* CHEMSPIDER:
 +
** [http://www.chemspider.com/Chemical-Structure.4445308.html 4445308]
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=87047 87047]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=31134 31134]
* HMDB : HMDB12165
+
* LIGAND-CPD:
{{#set: smiles=CC(C)CCCC([CH]4(C1(C)([CH](C2(=C(CC1)C3(C)([CH](CC2)C(C)(C([O-])=O)C(O)CC3)))CC4)))C}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C12204 C12204]
{{#set: inchi key=InChIKey=GLCDBDRQLZKKOJ-LJAIZBFVSA-M}}
+
{{#set: smiles=COC1(=CC(C=CC=O)=CC(O)=C(O)1)}}
{{#set: common name=4α-carboxy-4β-methyl-5α-cholesta-8-en-3β-ol}}
+
{{#set: inchi key=InChIKey=IEHPLRVWOHZKCS-NSCUHMNNSA-N}}
{{#set: molecular weight=443.688   }}
+
{{#set: common name=5-hydroxy-coniferaldehyde}}
{{#set: consumed by=RXN66-18}}
+
{{#set: molecular weight=194.187   }}
 +
{{#set: consumed by=RXN-1143}}

Revision as of 19:21, 18 March 2018

Metabolite 5-HYDROXY-CONIFERALDEHYDE

  • smiles:
    • COC1(=CC(C=CC=O)=CC(O)=C(O)1)
  • inchi key:
    • InChIKey=IEHPLRVWOHZKCS-NSCUHMNNSA-N
  • common name:
    • 5-hydroxy-coniferaldehyde
  • molecular weight:
    • 194.187
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links