Difference between revisions of "2-Me-Branched-234-Sat-FA"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ACRYLYL-COA ACRYLYL-COA] == * smiles: ** C=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=HIS HIS] == * smiles: ** C1(NC=NC=1CC(C(=O)[O-])[N+]) * inchi key: ** InChIKey=HNDVDQJCIGZPNO-Y...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ACRYLYL-COA ACRYLYL-COA] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=HIS HIS] ==
 
* smiles:
 
* smiles:
−
** C=CC(=O)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-]
+
** C1(NC=NC=1CC(C(=O)[O-])[N+])
 
* inchi key:
 
* inchi key:
−
** InChIKey=POODSGUMUCVRTR-IEXPHMLFSA-J
+
** InChIKey=HNDVDQJCIGZPNO-YFKPBYRVSA-N
 
* common name:
 
* common name:
−
** acryloyl-CoA
+
** L-histidine
 
* molecular weight:
 
* molecular weight:
−
** 817.551    
+
** 155.156    
 
* Synonym(s):
 
* Synonym(s):
−
** acrylyl-coenzyme A
+
** glyoxaline-5-alanine
−
** propenoyl-CoA
+
** α-amino-4-imidazoleproprionic acid
−
** acrylyl-CoA
+
** (S)-α-amino-1H-imidazole-4-propanoic acid
 +
** H
 +
** histidine
 +
** his
 +
** L-his
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[biomass_rxn]]
 +
* [[HISTIDINE-AMMONIA-LYASE-RXN]]
 +
* [[HISTIDINE-DECARBOXYLASE-RXN]]
 +
* [[HISTIDINE--TRNA-LIGASE-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN-8001]]
 +
* [[HISTALDEHYD-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[RXN-6383]]
 
 
== External links  ==
 
== External links  ==
−
* CAS : 5776-58-9
+
* CAS : 71-00-1
 +
* BIGG : 33985
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=45266595 45266595]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6971009 6971009]
−
* HMDB : HMDB02307
+
* HMDB : HMDB00177
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C00894 C00894]
+
** [http://www.genome.jp/dbget-bin/www_bget?C00135 C00135]
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57367 57367]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57595 57595]
−
* METABOLIGHTS : MTBLC57367
+
* METABOLIGHTS : MTBLC57595
−
{{#set: smiles=C=CC(=O)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-]}}
+
{{#set: smiles=C1(NC=NC=1CC(C(=O)[O-])[N+])}}
−
{{#set: inchi key=InChIKey=POODSGUMUCVRTR-IEXPHMLFSA-J}}
+
{{#set: inchi key=InChIKey=HNDVDQJCIGZPNO-YFKPBYRVSA-N}}
−
{{#set: common name=acryloyl-CoA}}
+
{{#set: common name=L-histidine}}
−
{{#set: molecular weight=817.551   }}
+
{{#set: molecular weight=155.156   }}
−
{{#set: common name=acrylyl-coenzyme A|propenoyl-CoA|acrylyl-CoA}}
+
{{#set: common name=glyoxaline-5-alanine|α-amino-4-imidazoleproprionic acid|(S)-α-amino-1H-imidazole-4-propanoic acid|H|histidine|his|L-his}}
−
{{#set: reversible reaction associated=RXN-6383}}
+
{{#set: consumed by=biomass_rxn|HISTIDINE-AMMONIA-LYASE-RXN|HISTIDINE-DECARBOXYLASE-RXN|HISTIDINE--TRNA-LIGASE-RXN}}
 +
{{#set: produced by=RXN-8001|HISTALDEHYD-RXN}}

Revision as of 13:58, 21 March 2018

Metabolite HIS

  • smiles:
    • C1(NC=NC=1CC(C(=O)[O-])[N+])
  • inchi key:
    • InChIKey=HNDVDQJCIGZPNO-YFKPBYRVSA-N
  • common name:
    • L-histidine
  • molecular weight:
    • 155.156
  • Synonym(s):
    • glyoxaline-5-alanine
    • α-amino-4-imidazoleproprionic acid
    • (S)-α-amino-1H-imidazole-4-propanoic acid
    • H
    • histidine
    • his
    • L-his

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 71-00-1
  • BIGG : 33985
  • PUBCHEM:
  • HMDB : HMDB00177
  • LIGAND-CPD:
  • CHEBI:
  • METABOLIGHTS : MTBLC57595
"C1(NC=NC=1CC(C(=O)[O-])[N+])" cannot be used as a page name in this wiki.




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