Difference between revisions of "DMPBQ"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CYCLOEUCALENOL CYCLOEUCALENOL] == * smiles: ** CC(C)C(=C)CCC(C)[CH]3(CCC4(C)([CH]1(CC[CH]5(C(C)...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=COBINAMIDE COBINAMIDE] == * smiles: ** CC(O)CNC(=O)CCC5(C)(C(CC(=O)N)[CH]7(C8(C)(C(C)(CC(N)=O)C...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CYCLOEUCALENOL CYCLOEUCALENOL] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=COBINAMIDE COBINAMIDE] ==
 
* smiles:
 
* smiles:
** CC(C)C(=C)CCC(C)[CH]3(CCC4(C)([CH]1(CC[CH]5(C(C)C(O)CCC2(CC12CCC(C)34)5))))
+
** CC(O)CNC(=O)CCC5(C)(C(CC(=O)N)[CH]7(C8(C)(C(C)(CC(N)=O)C(CCC(N)=O)C1(=[N+]([Co---]26([N+]4(C(=CC3(C(CCC(N)=O)C(C)(CC(N)=O)C(=C(C)1)[N+]2=3))C(C)(C)C(CCC(N)=O)C=4C(C)=C5N67)))8))))
* inchi key:
+
** InChIKey=HUNLTIZKNQDZEI-ZKZKKXEQSA-N
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* common name:
 
* common name:
** cycloeucalenol
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** cobinamide
 +
* inchi key:
 +
** InChIKey=XQRJFEVDQXEIAX-JFYQDRLCSA-M
 
* molecular weight:
 
* molecular weight:
** 426.724    
+
** 990.096    
 
* Synonym(s):
 
* Synonym(s):
 +
** Cbi
 +
** cobyrinic acid a,c-diamide
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[CYCLOEUCALENOL-CYCLOISOMERASE-RXN]]
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* [[BTUR2-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
* CAS : 469-39-6
+
* CAS : 1867-62-5
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=102515311 102515311]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=91820010 91820010]
* CHEBI:
+
* HMDB : HMDB06902
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16653 16653]
+
 
* LIGAND-CPD:
 
* LIGAND-CPD:
** [http://www.genome.jp/dbget-bin/www_bget?C02141 C02141]
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** [http://www.genome.jp/dbget-bin/www_bget?C05774 C05774]
{{#set: smiles=CC(C)C(=C)CCC(C)[CH]3(CCC4(C)([CH]1(CC[CH]5(C(C)C(O)CCC2(CC12CCC(C)34)5))))}}
+
* CHEBI:
{{#set: inchi key=InChIKey=HUNLTIZKNQDZEI-ZKZKKXEQSA-N}}
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=28956 28956]
{{#set: common name=cycloeucalenol}}
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* BIGG : cbi
{{#set: molecular weight=426.724    }}
+
{{#set: smiles=CC(O)CNC(=O)CCC5(C)(C(CC(=O)N)[CH]7(C8(C)(C(C)(CC(N)=O)C(CCC(N)=O)C1(=[N+]([Co---]26([N+]4(C(=CC3(C(CCC(N)=O)C(C)(CC(N)=O)C(=C(C)1)[N+]2=3))C(C)(C)C(CCC(N)=O)C=4C(C)=C5N67)))8))))}}
{{#set: consumed by=CYCLOEUCALENOL-CYCLOISOMERASE-RXN}}
+
{{#set: common name=cobinamide}}
 +
{{#set: inchi key=InChIKey=XQRJFEVDQXEIAX-JFYQDRLCSA-M}}
 +
{{#set: molecular weight=990.096    }}
 +
{{#set: common name=Cbi|cobyrinic acid a,c-diamide}}
 +
{{#set: consumed by=BTUR2-RXN}}

Revision as of 15:56, 21 March 2018

Metabolite COBINAMIDE

  • smiles:
    • CC(O)CNC(=O)CCC5(C)(C(CC(=O)N)[CH]7(C8(C)(C(C)(CC(N)=O)C(CCC(N)=O)C1(=[N+]([Co---]26([N+]4(C(=CC3(C(CCC(N)=O)C(C)(CC(N)=O)C(=C(C)1)[N+]2=3))C(C)(C)C(CCC(N)=O)C=4C(C)=C5N67)))8))))
  • common name:
    • cobinamide
  • inchi key:
    • InChIKey=XQRJFEVDQXEIAX-JFYQDRLCSA-M
  • molecular weight:
    • 990.096
  • Synonym(s):
    • Cbi
    • cobyrinic acid a,c-diamide

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 1867-62-5
  • PUBCHEM:
  • HMDB : HMDB06902
  • LIGAND-CPD:
  • CHEBI:
  • BIGG : cbi
"CC(O)CNC(=O)CCC5(C)(C(CC(=O)N)[CH]7(C8(C)(C(C)(CC(N)=O)C(CCC(N)=O)C1(=[N+]([Co---]26([N+]4(C(=CC3(C(CCC(N)=O)C(C)(CC(N)=O)C(=C(C)1)[N+]2=3))C(C)(C)C(CCC(N)=O)C=4C(C)=C5N67)))8))))" cannot be used as a page name in this wiki.