Difference between revisions of "Ec-19 000810"

From metabolic_network
Jump to: navigation, search
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=TYR TYR] == * smiles: ** C(C(CC1(C=CC(O)=CC=1))[N+])(=O)[O-] * inchi key: ** InChIKey=OUYCCCASQ...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-653 CPD-653] == * smiles: ** C1(=C(CCC(O)N1C5(OC(COP(=O)([O-])OP(=O)([O-])OCC2(OC(C(O)C(O)2...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=TYR TYR] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-653 CPD-653] ==
 
* smiles:
 
* smiles:
−
** C(C(CC1(C=CC(O)=CC=1))[N+])(=O)[O-]
+
** C1(=C(CCC(O)N1C5(OC(COP(=O)([O-])OP(=O)([O-])OCC2(OC(C(O)C(O)2)N4(C=NC3(C(N)=NC=NC=34))))C(O)C(O)5))C(N)=O)
 
* inchi key:
 
* inchi key:
−
** InChIKey=OUYCCCASQSFEME-QMMMGPOBSA-N
+
** InChIKey=IDBZKGQRLBFUFQ-VPHRTNKSSA-L
 
* common name:
 
* common name:
−
** L-tyrosine
+
** (S)-NADHX
 
* molecular weight:
 
* molecular weight:
−
** 181.191    
+
** 681.445    
 
* Synonym(s):
 
* Synonym(s):
−
** Y
+
** (6S)-6-β-hydroxy-1,4,5,6-tetrahydronicotinamide-adenine dinucleotide
−
** tyr
+
−
** tyrosine
+
−
** L-tyr
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[biomass_rxn]]
 
−
* [[6.3.2.25-RXN]]
 
−
* [[MONOPHENOL-MONOOXYGENASE-RXN]]
 
−
* [[TYROSINE-DECARBOXYLASE-RXN]]
 
−
* [[TYROSINE--TRNA-LIGASE-RXN]]
 
−
* [[RXN-5861]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[CYCLOHEXADIENYL-DEHYDROGENASE-RXN]]
+
* [[RXN-12753]]
−
* [[RXN66-569]]
+
−
* [[R15-RXN-MET/P-HYDROXY-PHENYLPYRUVATE//CPD-479/TYR.42.]]
+
−
* [[RXN-5682]]
+
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[L-AMINO-ACID-DEHYDROGENASE-RXN-TYR/NAD/WATER//P-HYDROXY-PHENYLPYRUVATE/AMMONIUM/NADH/PROTON.61.]]
 
−
* [[RXN3O-4157]]
 
−
* [[2.6.1.14-RXN-P-HYDROXY-PHENYLPYRUVATE/ASN//2-OXOSUCCINAMATE/TYR.51.]]
 
−
* [[ORNITHINE--OXO-ACID-AMINOTRANSFERASE-RXN-L-ORNITHINE/P-HYDROXY-PHENYLPYRUVATE//TYR/L-GLUTAMATE_GAMMA-SEMIALDEHYDE.73.]]
 
−
* [[TYROSINE-AMINOTRANSFERASE-RXN]]
 
−
* [[RXN-15200]]
 
−
* [[RXN-14476]]
 
 
== External links  ==
 
== External links  ==
−
* CAS : 60-18-4
 
−
* BIGG : 33785
 
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6942100 6942100]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25203523 25203523]
−
* HMDB : HMDB00158
+
−
* LIGAND-CPD:
+
−
** [http://www.genome.jp/dbget-bin/www_bget?C00082 C00082]
+
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58315 58315]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=64074 64074]
−
* METABOLIGHTS : MTBLC58315
+
* LIGAND-CPD:
−
{{#set: smiles=C(C(CC1(C=CC(O)=CC=1))[N+])(=O)[O-]}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C04856 C04856]
−
{{#set: inchi key=InChIKey=OUYCCCASQSFEME-QMMMGPOBSA-N}}
+
* HMDB : HMDB59644
−
{{#set: common name=L-tyrosine}}
+
{{#set: smiles=C1(=C(CCC(O)N1C5(OC(COP(=O)([O-])OP(=O)([O-])OCC2(OC(C(O)C(O)2)N4(C=NC3(C(N)=NC=NC=34))))C(O)C(O)5))C(N)=O)}}
−
{{#set: molecular weight=181.191   }}
+
{{#set: inchi key=InChIKey=IDBZKGQRLBFUFQ-VPHRTNKSSA-L}}
−
{{#set: common name=Y|tyr|tyrosine|L-tyr}}
+
{{#set: common name=(S)-NADHX}}
−
{{#set: consumed by=biomass_rxn|6.3.2.25-RXN|MONOPHENOL-MONOOXYGENASE-RXN|TYROSINE-DECARBOXYLASE-RXN|TYROSINE--TRNA-LIGASE-RXN|RXN-5861}}
+
{{#set: molecular weight=681.445   }}
−
{{#set: produced by=CYCLOHEXADIENYL-DEHYDROGENASE-RXN|RXN66-569|R15-RXN-MET/P-HYDROXY-PHENYLPYRUVATE//CPD-479/TYR.42.|RXN-5682}}
+
{{#set: common name=(6S)-6-β-hydroxy-1,4,5,6-tetrahydronicotinamide-adenine dinucleotide}}
−
{{#set: consumed or produced by=L-AMINO-ACID-DEHYDROGENASE-RXN-TYR/NAD/WATER//P-HYDROXY-PHENYLPYRUVATE/AMMONIUM/NADH/PROTON.61.|RXN3O-4157|2.6.1.14-RXN-P-HYDROXY-PHENYLPYRUVATE/ASN//2-OXOSUCCINAMATE/TYR.51.|ORNITHINE--OXO-ACID-AMINOTRANSFERASE-RXN-L-ORNITHINE/P-HYDROXY-PHENYLPYRUVATE//TYR/L-GLUTAMATE_GAMMA-SEMIALDEHYDE.73.|TYROSINE-AMINOTRANSFERASE-RXN|RXN-15200|RXN-14476}}
+
{{#set: produced by=RXN-12753}}

Revision as of 21:57, 17 March 2018

Metabolite CPD-653

  • smiles:
    • C1(=C(CCC(O)N1C5(OC(COP(=O)([O-])OP(=O)([O-])OCC2(OC(C(O)C(O)2)N4(C=NC3(C(N)=NC=NC=34))))C(O)C(O)5))C(N)=O)
  • inchi key:
    • InChIKey=IDBZKGQRLBFUFQ-VPHRTNKSSA-L
  • common name:
    • (S)-NADHX
  • molecular weight:
    • 681.445
  • Synonym(s):
    • (6S)-6-β-hydroxy-1,4,5,6-tetrahydronicotinamide-adenine dinucleotide

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"C1(=C(CCC(O)N1C5(OC(COP(=O)([O-])OP(=O)([O-])OCC2(OC(C(O)C(O)2)N4(C=NC3(C(N)=NC=NC=34))))C(O)C(O)5))C(N)=O)" cannot be used as a page name in this wiki.



Retrieved from "http://gem-aureme.irisa.fr/ectogem/index.php?title=Ec-19_000810&oldid=15167"