Difference between revisions of "CPD-7037"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-206 CPD-206] == * smiles: ** CC(C)CCCC(C)CCCC(C)CCCC(C)CC(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7037 CPD-7037] == * smiles: ** CSCCCO * inchi key: ** InChIKey=CZUGFKJYCPYHHV-UHFFFAOYSA-N...")
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-206 CPD-206] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7037 CPD-7037] ==
 
* smiles:
 
* smiles:
** CC(C)CCCC(C)CCCC(C)CCCC(C)CC(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-])=O
+
** CSCCCO
 
* inchi key:
 
* inchi key:
** InChIKey=NRJQGHHZMSOUEN-HHVNVSIESA-J
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** InChIKey=CZUGFKJYCPYHHV-UHFFFAOYSA-N
 
* common name:
 
* common name:
** phytanoyl-CoA
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** methionol
 
* molecular weight:
 
* molecular weight:
** 1058.022    
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** 106.182    
 
* Synonym(s):
 
* Synonym(s):
 +
** methylmercaptopropanol
 +
** 3-methylthiopropanol
 +
** 3-methylmercapto-1-propanol
 +
** 3-hydroxypropyl methyl sulfide
 +
** γ-methylmercaptopropyl alcohol
 +
** 3-methylsulfanyl-1-propanol
  
 
== 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 ==
* [[RXN66-482]]
+
* [[RXN-7706]]
 
== 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=90658363 90658363]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=10448 10448]
 +
* CHEMSPIDER:
 +
** [http://www.chemspider.com/Chemical-Structure.10016.html 10016]
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=15538 15538]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=49019 49019]
* LIGAND-CPD:
+
* METABOLIGHTS : MTBLC49019
** [http://www.genome.jp/dbget-bin/www_bget?C02060 C02060]
+
* HMDB : HMDB31716
* HMDB : HMDB01359
+
{{#set: smiles=CSCCCO}}
{{#set: smiles=CC(C)CCCC(C)CCCC(C)CCCC(C)CC(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-])=O}}
+
{{#set: inchi key=InChIKey=CZUGFKJYCPYHHV-UHFFFAOYSA-N}}
{{#set: inchi key=InChIKey=NRJQGHHZMSOUEN-HHVNVSIESA-J}}
+
{{#set: common name=methionol}}
{{#set: common name=phytanoyl-CoA}}
+
{{#set: molecular weight=106.182   }}
{{#set: molecular weight=1058.022   }}
+
{{#set: common name=methylmercaptopropanol|3-methylthiopropanol|3-methylmercapto-1-propanol|3-hydroxypropyl methyl sulfide|γ-methylmercaptopropyl alcohol|3-methylsulfanyl-1-propanol}}
{{#set: produced by=RXN66-482}}
+
{{#set: produced by=RXN-7706}}

Revision as of 17:42, 23 May 2018

Metabolite CPD-7037

  • smiles:
    • CSCCCO
  • inchi key:
    • InChIKey=CZUGFKJYCPYHHV-UHFFFAOYSA-N
  • common name:
    • methionol
  • molecular weight:
    • 106.182
  • Synonym(s):
    • methylmercaptopropanol
    • 3-methylthiopropanol
    • 3-methylmercapto-1-propanol
    • 3-hydroxypropyl methyl sulfide
    • γ-methylmercaptopropyl alcohol
    • 3-methylsulfanyl-1-propanol

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • PUBCHEM:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC49019
  • HMDB : HMDB31716