Difference between revisions of "Tiso gene 12535"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-3187 CPD-3187] == * smiles: ** C1(CCC(O)([N+](C)1)C2(=CN=CC=C2)) * inchi key: ** InChIKey=B...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11497 CPD-11497] == * smiles: ** COC1(=C(O)C=CC(C(O)CO)=C1) * common name: ** 3-methoxy-4-h...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-3187 CPD-3187] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11497 CPD-11497] ==
 
* smiles:
 
* smiles:
−
** C1(CCC(O)([N+](C)1)C2(=CN=CC=C2))
+
** COC1(=C(O)C=CC(C(O)CO)=C1)
−
* inchi key:
+
−
** InChIKey=BOQRPPFUUSHFGW-SNVBAGLBSA-O
+
 
* common name:
 
* common name:
−
** 2'-hydroxynicotine
+
** 3-methoxy-4-hydroxyphenylglycol
 +
* inchi key:
 +
** InChIKey=FBWPWWWZWKPJFL-QMMMGPOBSA-N
 
* molecular weight:
 
* molecular weight:
−
** 179.241    
+
** 184.191    
 
* Synonym(s):
 
* Synonym(s):
 +
** methoxyhydroxyphenylglycol
 +
** vanylglycol
 +
** MHPG piperazine
 +
** MHPG
 +
** MOPEG
 +
** methoxy-hydroxyphenyl glycol
 +
** 4-hydroxy-3-methoxyphenylglycol
 +
** hydroxymethoxyphenylglycol
 +
** HMPG
  
 
== 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 ==
−
* [[RXN66-146]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 +
* [[RXN-10915]]
 
== External links  ==
 
== External links  ==
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25245599 25245599]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=688030 688030]
−
* HMDB : HMDB01329
+
* CHEMSPIDER:
−
{{#set: smiles=C1(CCC(O)([N+](C)1)C2(=CN=CC=C2))}}
+
** [http://www.chemspider.com/Chemical-Structure.10348.html 10348]
−
{{#set: inchi key=InChIKey=BOQRPPFUUSHFGW-SNVBAGLBSA-O}}
+
* HMDB : HMDB01490
−
{{#set: common name=2'-hydroxynicotine}}
+
* LIGAND-CPD:
−
{{#set: molecular weight=179.241   }}
+
** [http://www.genome.jp/dbget-bin/www_bget?C05594 C05594]
−
{{#set: produced by=RXN66-146}}
+
{{#set: smiles=COC1(=C(O)C=CC(C(O)CO)=C1)}}
 +
{{#set: common name=3-methoxy-4-hydroxyphenylglycol}}
 +
{{#set: inchi key=InChIKey=FBWPWWWZWKPJFL-QMMMGPOBSA-N}}
 +
{{#set: molecular weight=184.191   }}
 +
{{#set: common name=methoxyhydroxyphenylglycol|vanylglycol|MHPG piperazine|MHPG|MOPEG|methoxy-hydroxyphenyl glycol|4-hydroxy-3-methoxyphenylglycol|hydroxymethoxyphenylglycol|HMPG}}
 +
{{#set: reversible reaction associated=RXN-10915}}

Revision as of 15:40, 21 March 2018

Metabolite CPD-11497

  • smiles:
    • COC1(=C(O)C=CC(C(O)CO)=C1)
  • common name:
    • 3-methoxy-4-hydroxyphenylglycol
  • inchi key:
    • InChIKey=FBWPWWWZWKPJFL-QMMMGPOBSA-N
  • molecular weight:
    • 184.191
  • Synonym(s):
    • methoxyhydroxyphenylglycol
    • vanylglycol
    • MHPG piperazine
    • MHPG
    • MOPEG
    • methoxy-hydroxyphenyl glycol
    • 4-hydroxy-3-methoxyphenylglycol
    • hydroxymethoxyphenylglycol
    • HMPG

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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