Difference between revisions of "C5"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=2-HYDROXY-2-METHYLPROPANENITRILE 2-HYDROXY-2-METHYLPROPANENITRILE] == * smiles: ** CC(O)(C)C#N...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=C5 C5] == * smiles: ** CC(C)=CCCC(C)=CCCC(C)=CCCC(=CCCC(=CCCC(=CCCC(C)=CCCC(=CCCC(=CCCC(=CCCC(=...")
 
(One intermediate revision by the same user not shown)
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=2-HYDROXY-2-METHYLPROPANENITRILE 2-HYDROXY-2-METHYLPROPANENITRILE] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=C5 C5] ==
 
* smiles:
 
* smiles:
−
** CC(O)(C)C#N
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** CC(C)=CCCC(C)=CCCC(C)=CCCC(=CCCC(=CCCC(=CCCC(C)=CCCC(=CCCC(=CCCC(=CCCC(=CCOP(OP([O-])(=O)OC1(C(NC(=O)C)C(OC(C)C(=O)NC(C)C(=O)NC(C(=O)[O-])CCC(=O)NC(CCCC([N+])C(=O)[O-])C(NC(C)C(=O)NC(C)C([O-])=O)=O)C(O)C(CO)O1))([O-])=O)C)C)C)C)C)C)C
 
* inchi key:
 
* inchi key:
−
** InChIKey=MWFMGBPGAXYFAR-UHFFFAOYSA-N
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** InChIKey=PNWZQTONLRRPST-KLDRQJOASA-J
 
* common name:
 
* common name:
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** acetone cyanohydrin
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** undecaprenyldiphospho-N-acetylmuramoyl-L-alanyl-γ-D-glutamyl-meso-2,6-diaminopimeloyl-D-alanyl-D-alanine
 
* molecular weight:
 
* molecular weight:
−
** 85.105    
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** 1713.036    
 
* Synonym(s):
 
* Synonym(s):
−
** 2-hydroxy-2-methylpropanenitrile
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** N-acetylmuramoyl-L-alanyl-D-glutamyl-meso-2,6-diaminoheptanedioate-D-alanyl-D-alanine-diphosphoundecaprenol
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** 2-hydroxyisobutyronitrile
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** a peptidoglycan with cleaved N-acetyl-glucosamine
 +
** lipid intermediate I
 +
** undecaprenyl-pyrophosphoryl-MurNAc-pentapeptide
 +
** lipid I
  
 
== 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 ==
−
* [[RXN-5341]]
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* [[PHOSNACMURPENTATRANS-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
−
* NCI:
 
−
** [http://cactus.nci.nih.gov/ncidb2.2/?nsc=131093 131093]
 
−
* CAS : 75-86-5
 
−
* DRUGBANK : DB02203
 
 
* PUBCHEM:
 
* PUBCHEM:
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6406 6406]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=52940090 52940090]
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* HMDB : HMDB60427
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−
* LIGAND-CPD:
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** [http://www.genome.jp/dbget-bin/www_bget?C02659 C02659]
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−
* CHEMSPIDER:
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−
** [http://www.chemspider.com/Chemical-Structure.6166.html 6166]
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* CHEBI:
 
* CHEBI:
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=15348 15348]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=61387 61387]
−
{{#set: smiles=CC(O)(C)C#N}}
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* BIGG : 46787
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{{#set: inchi key=InChIKey=MWFMGBPGAXYFAR-UHFFFAOYSA-N}}
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* LIGAND-CPD:
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{{#set: common name=acetone cyanohydrin}}
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** [http://www.genome.jp/dbget-bin/www_bget?C05897 C05897]
−
{{#set: molecular weight=85.105   }}
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{{#set: smiles=CC(C)=CCCC(C)=CCCC(C)=CCCC(=CCCC(=CCCC(=CCCC(C)=CCCC(=CCCC(=CCCC(=CCCC(=CCOP(OP([O-])(=O)OC1(C(NC(=O)C)C(OC(C)C(=O)NC(C)C(=O)NC(C(=O)[O-])CCC(=O)NC(CCCC([N+])C(=O)[O-])C(NC(C)C(=O)NC(C)C([O-])=O)=O)C(O)C(CO)O1))([O-])=O)C)C)C)C)C)C)C}}
−
{{#set: common name=2-hydroxy-2-methylpropanenitrile|2-hydroxyisobutyronitrile}}
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{{#set: inchi key=InChIKey=PNWZQTONLRRPST-KLDRQJOASA-J}}
−
{{#set: produced by=RXN-5341}}
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{{#set: common name=undecaprenyldiphospho-N-acetylmuramoyl-L-alanyl-γ-D-glutamyl-meso-2,6-diaminopimeloyl-D-alanyl-D-alanine}}
 +
{{#set: molecular weight=1713.036   }}
 +
{{#set: common name=N-acetylmuramoyl-L-alanyl-D-glutamyl-meso-2,6-diaminoheptanedioate-D-alanyl-D-alanine-diphosphoundecaprenol|a peptidoglycan with cleaved N-acetyl-glucosamine|lipid intermediate I|undecaprenyl-pyrophosphoryl-MurNAc-pentapeptide|lipid I}}
 +
{{#set: produced by=PHOSNACMURPENTATRANS-RXN}}

Latest revision as of 20:53, 21 March 2018

Metabolite C5

  • smiles:
    • CC(C)=CCCC(C)=CCCC(C)=CCCC(=CCCC(=CCCC(=CCCC(C)=CCCC(=CCCC(=CCCC(=CCCC(=CCOP(OP([O-])(=O)OC1(C(NC(=O)C)C(OC(C)C(=O)NC(C)C(=O)NC(C(=O)[O-])CCC(=O)NC(CCCC([N+])C(=O)[O-])C(NC(C)C(=O)NC(C)C([O-])=O)=O)C(O)C(CO)O1))([O-])=O)C)C)C)C)C)C)C
  • inchi key:
    • InChIKey=PNWZQTONLRRPST-KLDRQJOASA-J
  • common name:
    • undecaprenyldiphospho-N-acetylmuramoyl-L-alanyl-γ-D-glutamyl-meso-2,6-diaminopimeloyl-D-alanyl-D-alanine
  • molecular weight:
    • 1713.036
  • Synonym(s):
    • N-acetylmuramoyl-L-alanyl-D-glutamyl-meso-2,6-diaminoheptanedioate-D-alanyl-D-alanine-diphosphoundecaprenol
    • a peptidoglycan with cleaved N-acetyl-glucosamine
    • lipid intermediate I
    • undecaprenyl-pyrophosphoryl-MurNAc-pentapeptide
    • lipid I

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CC(C)=CCCC(C)=CCCC(C)=CCCC(=CCCC(=CCCC(=CCCC(C)=CCCC(=CCCC(=CCCC(=CCCC(=CCOP(OP([O-])(=O)OC1(C(NC(=O)C)C(OC(C)C(=O)NC(C)C(=O)NC(C(=O)[O-])CCC(=O)NC(CCCC([N+])C(=O)[O-])C(NC(C)C(=O)NC(C)C([O-])=O)=O)C(O)C(CO)O1))([O-])=O)C)C)C)C)C)C)C" cannot be used as a page name in this wiki.



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