Difference between revisions of "CPD-388"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-289 CPD-289] == * smiles: ** C1(=CC(C(C=C1)O)O) * common name: ** (1R,2R)-cyclohexa-3,5-die...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-388 CPD-388] == * smiles: ** CCCCCCCCCCCCCC[CH]=O * inchi key: ** InChIKey=XGQJZNCFDLXSIJ-U...")
 
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-289 CPD-289] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-388 CPD-388] ==
 
* smiles:
 
* smiles:
** C1(=CC(C(C=C1)O)O)
+
** CCCCCCCCCCCCCC[CH]=O
* common name:
+
** (1R,2R)-cyclohexa-3,5-diene-1,2-diol
+
 
* inchi key:
 
* inchi key:
** InChIKey=YDRSQRPHLBEPTP-PHDIDXHHSA-N
+
** InChIKey=XGQJZNCFDLXSIJ-UHFFFAOYSA-N
 +
* common name:
 +
** pentadecanal
 
* molecular weight:
 
* molecular weight:
** 112.128    
+
** 226.401    
 
* Synonym(s):
 
* Synonym(s):
** trans-1,2-dihydrobenzene-1,2-diol
 
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN66-476-CPD-388/NAD/WATER//CPD-8462/NADH/PROTON.40.]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[FATTY-ACID-PEROXIDASE-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
* [[1.3.1.20-RXN]]
 
 
== External links  ==
 
== External links  ==
 +
* CAS : 2765-11-9
 +
* LIPID_MAPS : LMFA06000083
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=149186 149186]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=17697 17697]
 +
* HMDB : HMDB31078
 +
* LIGAND-CPD:
 +
** [http://www.genome.jp/dbget-bin/www_bget?C01948 C01948]
 
* CHEMSPIDER:
 
* CHEMSPIDER:
** [http://www.chemspider.com/Chemical-Structure.131491.html 131491]
+
** [http://www.chemspider.com/Chemical-Structure.16729.html 16729]
* HMDB : HMDB01164
+
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=10702 10702]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17302 17302]
* LIGAND-CPD:
+
{{#set: smiles=CCCCCCCCCCCCCC[CH]=O}}
** [http://www.genome.jp/dbget-bin/www_bget?C04221 C04221]
+
{{#set: inchi key=InChIKey=XGQJZNCFDLXSIJ-UHFFFAOYSA-N}}
{{#set: smiles=C1(=CC(C(C=C1)O)O)}}
+
{{#set: common name=pentadecanal}}
{{#set: common name=(1R,2R)-cyclohexa-3,5-diene-1,2-diol}}
+
{{#set: molecular weight=226.401   }}
{{#set: inchi key=InChIKey=YDRSQRPHLBEPTP-PHDIDXHHSA-N}}
+
{{#set: consumed by=RXN66-476-CPD-388/NAD/WATER//CPD-8462/NADH/PROTON.40.}}
{{#set: molecular weight=112.128   }}
+
{{#set: produced by=FATTY-ACID-PEROXIDASE-RXN}}
{{#set: common name=trans-1,2-dihydrobenzene-1,2-diol}}
+
{{#set: reversible reaction associated=1.3.1.20-RXN}}
+

Latest revision as of 20:48, 21 March 2018

Metabolite CPD-388

  • smiles:
    • CCCCCCCCCCCCCC[CH]=O
  • inchi key:
    • InChIKey=XGQJZNCFDLXSIJ-UHFFFAOYSA-N
  • common name:
    • pentadecanal
  • molecular weight:
    • 226.401
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 2765-11-9
  • LIPID_MAPS : LMFA06000083
  • PUBCHEM:
  • HMDB : HMDB31078
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
"CCCCCCCCCCCCCC[CH]=O" cannot be used as a page name in this wiki.