Difference between revisions of "CPD-7830"

From metabolic_network
Jump to: navigation, search
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=5-10-METHENYL-THF 5-10-METHENYL-THF] == * smiles: ** C4(NC1(N=C(N)NC(=O)C=1[N+]3(=CN(C2(=CC=C(C...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7830 CPD-7830] == * smiles: ** CCCCCCCCCCCCCCCCC([O-])=O * inchi key: ** InChIKey=KEMQGTRYU...")
 
(3 intermediate revisions by the same user not shown)
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=5-10-METHENYL-THF 5-10-METHENYL-THF] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7830 CPD-7830] ==
 
* smiles:
 
* smiles:
−
** C4(NC1(N=C(N)NC(=O)C=1[N+]3(=CN(C2(=CC=C(C=C2)C(=O)NC(CCC([O-])=O)C([O-])=O))C[CH]34)))
+
** CCCCCCCCCCCCCCCCC([O-])=O
 
* inchi key:
 
* inchi key:
−
** InChIKey=MEANFMOQMXYMCT-OLZOCXBDSA-M
+
** InChIKey=KEMQGTRYUADPNZ-UHFFFAOYSA-M
 
* common name:
 
* common name:
−
** 5,10-methenyltetrahydrofolate mono-L-glutamate
+
** heptadecanoate
 
* molecular weight:
 
* molecular weight:
−
** 454.421    
+
** 269.446    
 
* Synonym(s):
 
* Synonym(s):
−
** N5-N10-CH-THF mono-L-glutamate
+
** margaric acid
−
** N5-N10-methenyltetrahydrofolate mono-L-glutamate
+
** margarate
−
** CH-THF mono-L-glutamate
+
** heptadecanoic acid
−
** 5,10-methenyl-THF mono-L-glutamate
+
−
** anhydroleucovorin mono-L-glutamate
+
−
** methenyl-tetrahydrofolate mono-L-glutamate
+
−
** methenyl-THF mono-L-glutamate
+
−
** methenyl-H4F mono-L-glutamate
+
−
** 5,10-methenyl-H4PteGlu1
+
  
 
== 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 ==
−
* [[MTHFCx]]
+
* [[RXN66-476-CPD-14719/NAD/WATER//CPD-7830/NADH/PROTON.42.]]
−
* [[FGFTm]]
+
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[METHFtm]]
 
−
* [[R01655]]
 
−
* [[METHFth]]
 
−
* [[MTHFor_nadp]]
 
−
* [[R01220]]
 
−
* [[METHFtx]]
 
 
== External links  ==
 
== External links  ==
−
* CAS : 7444-29-3
 
−
* METABOLIGHTS : MTBLC57455
 
−
* PUBCHEM:
 
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=46878371 46878371]
 
−
* HMDB : HMDB01354
 
−
* LIGAND-CPD:
 
−
** [http://www.genome.jp/dbget-bin/www_bget?C00445 C00445]
 
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57455 57455]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=32366 32366]
−
* BIGG : methf
+
* CHEMSPIDER:
−
{{#set: smiles=C4(NC1(N=C(N)NC(=O)C=1[N+]3(=CN(C2(=CC=C(C=C2)C(=O)NC(CCC([O-])=O)C([O-])=O))C[CH]34)))}}
+
** [http://www.chemspider.com/Chemical-Structure.3327058.html 3327058]
−
{{#set: inchi key=InChIKey=MEANFMOQMXYMCT-OLZOCXBDSA-M}}
+
* Wikipedia : Heptadecanoic_acid
−
{{#set: common name=5,10-methenyltetrahydrofolate mono-L-glutamate}}
+
* METABOLIGHTS : MTBLC32366
−
{{#set: molecular weight=454.421   }}
+
* PUBCHEM:
−
{{#set: common name=N5-N10-CH-THF mono-L-glutamate|N5-N10-methenyltetrahydrofolate mono-L-glutamate|CH-THF mono-L-glutamate|5,10-methenyl-THF mono-L-glutamate|anhydroleucovorin mono-L-glutamate|methenyl-tetrahydrofolate mono-L-glutamate|methenyl-THF mono-L-glutamate|methenyl-H4F mono-L-glutamate|5,10-methenyl-H4PteGlu1}}
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=4113470 4113470]
−
{{#set: produced by=MTHFCx|FGFTm}}
+
{{#set: smiles=CCCCCCCCCCCCCCCCC([O-])=O}}
−
{{#set: consumed or produced by=METHFtm|R01655|METHFth|MTHFor_nadp|R01220|METHFtx}}
+
{{#set: inchi key=InChIKey=KEMQGTRYUADPNZ-UHFFFAOYSA-M}}
 +
{{#set: common name=heptadecanoate}}
 +
{{#set: molecular weight=269.446   }}
 +
{{#set: common name=margaric acid|margarate|heptadecanoic acid}}
 +
{{#set: produced by=RXN66-476-CPD-14719/NAD/WATER//CPD-7830/NADH/PROTON.42.}}

Latest revision as of 19:13, 21 March 2018

Metabolite CPD-7830

  • smiles:
    • CCCCCCCCCCCCCCCCC([O-])=O
  • inchi key:
    • InChIKey=KEMQGTRYUADPNZ-UHFFFAOYSA-M
  • common name:
    • heptadecanoate
  • molecular weight:
    • 269.446
  • Synonym(s):
    • margaric acid
    • margarate
    • heptadecanoic acid

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CHEBI:
  • CHEMSPIDER:
  • Wikipedia : Heptadecanoic_acid
  • METABOLIGHTS : MTBLC32366
  • PUBCHEM:
"CCCCCCCCCCCCCCCCC([O-])=O" cannot be used as a page name in this wiki.



Retrieved from "http://gem-aureme.irisa.fr/tisogem/index.php?title=CPD-7830&oldid=40204"