Difference between revisions of "Tiso gene 15138"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=THIAMINE-P THIAMINE-P] == * smiles: ** CC1([N+](=CSC(CCOP([O-])(=O)[O-])=1)CC2(C=NC(C)=NC(N)=2)...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-19512 CPD-19512] == * smiles: ** C(=[N-])=S * inchi key: ** InChIKey=ZBKFYXZXZJPWNQ-UHFFFAO...")
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=THIAMINE-P THIAMINE-P] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-19512 CPD-19512] ==
 
* smiles:
 
* smiles:
−
** CC1([N+](=CSC(CCOP([O-])(=O)[O-])=1)CC2(C=NC(C)=NC(N)=2))
+
** C(=[N-])=S
 
* inchi key:
 
* inchi key:
−
** InChIKey=HZSAJDVWZRBGIF-UHFFFAOYSA-M
+
** InChIKey=ZBKFYXZXZJPWNQ-UHFFFAOYSA-N
 
* common name:
 
* common name:
−
** thiamine phosphate
+
** isothiocyanate
 
* molecular weight:
 
* molecular weight:
−
** 343.317    
+
** 58.078    
 
* Synonym(s):
 
* Synonym(s):
−
** TMP
+
** isothiocyanic acid
−
** thiamin monophosphate
+
−
** thiamin phosphate
+
−
** thiamin-P
+
−
** thiamine-Pi
+
−
** ThP
+
−
** thiamine monophosphate
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXNQT-4191]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[THI-P-SYN-RXN]]
 
−
* [[RXN-12610]]
 
−
* [[RXN-12611]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[RXN0-3542]]
+
* [[RXN-18232]]
 
== External links  ==
 
== External links  ==
−
* CAS : 532-40-1
 
−
* METABOLIGHTS : MTBLC37575
 
−
* PUBCHEM:
 
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=15942892 15942892]
 
−
* HMDB : HMDB02666
 
−
* LIGAND-CPD:
 
−
** [http://www.genome.jp/dbget-bin/www_bget?C01081 C01081]
 
 
* CHEMSPIDER:
 
* CHEMSPIDER:
−
** [http://www.chemspider.com/Chemical-Structure.13085545.html 13085545]
+
** [http://www.chemspider.com/Chemical-Structure.10445869.html 10445869]
−
* CHEBI:
+
{{#set: smiles=C(=[N-])=S}}
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=37575 37575]
+
{{#set: inchi key=InChIKey=ZBKFYXZXZJPWNQ-UHFFFAOYSA-N}}
−
* BIGG : thmmp
+
{{#set: common name=isothiocyanate}}
−
{{#set: smiles=CC1([N+](=CSC(CCOP([O-])(=O)[O-])=1)CC2(C=NC(C)=NC(N)=2))}}
+
{{#set: molecular weight=58.078   }}
−
{{#set: inchi key=InChIKey=HZSAJDVWZRBGIF-UHFFFAOYSA-M}}
+
{{#set: common name=isothiocyanic acid}}
−
{{#set: common name=thiamine phosphate}}
+
{{#set: reversible reaction associated=RXN-18232}}
−
{{#set: molecular weight=343.317   }}
+
−
{{#set: common name=TMP|thiamin monophosphate|thiamin phosphate|thiamin-P|thiamine-Pi|ThP|thiamine monophosphate}}
+
−
{{#set: consumed by=RXNQT-4191}}
+
−
{{#set: produced by=THI-P-SYN-RXN|RXN-12610|RXN-12611}}
+
−
{{#set: consumed or produced by=RXN0-3542}}
+

Revision as of 18:47, 18 March 2018

Metabolite CPD-19512

  • smiles:
    • C(=[N-])=S
  • inchi key:
    • InChIKey=ZBKFYXZXZJPWNQ-UHFFFAOYSA-N
  • common name:
    • isothiocyanate
  • molecular weight:
    • 58.078
  • Synonym(s):
    • isothiocyanic acid

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"C(=[N-])=S" cannot be used as a page name in this wiki.



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