Difference between revisions of "CPD-10546"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=MESO-DIAMINOPIMELATE MESO-DIAMINOPIMELATE] == * smiles: ** C(C(CCCC(C([O-])=O)[N+])[N+])([O-])=...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ISOBUTANOL ISOBUTANOL] == * smiles: ** CC(C)CO * common name: ** isobutanol * inchi key: ** InC...")
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=MESO-DIAMINOPIMELATE MESO-DIAMINOPIMELATE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ISOBUTANOL ISOBUTANOL] ==
 
* smiles:
 
* smiles:
−
** C(C(CCCC(C([O-])=O)[N+])[N+])([O-])=O
+
** CC(C)CO
−
* inchi key:
+
−
** InChIKey=GMKMEZVLHJARHF-SYDPRGILSA-N
+
 
* common name:
 
* common name:
−
** meso-diaminopimelate
+
** isobutanol
 +
* inchi key:
 +
** InChIKey=ZXEKIIBDNHEJCQ-UHFFFAOYSA-N
 
* molecular weight:
 
* molecular weight:
−
** 190.199    
+
** 74.122    
 
* Synonym(s):
 
* Synonym(s):
−
** meso-2,6-diaminopimelate
+
** 2-methyl-1-propanol
−
** meso-A2pm
+
** 1-hydroxymethylpropane
−
** meso-diaminoheptanedioate
+
** 2-methylpropanol
−
** meso-2,6-diaminoheptanedioate
+
** isobutyl alcohol
−
** meso-1-α,ε-diaminopimelate
+
−
** D,L-diaminopimelate
+
−
** D,L-DAP
+
−
** D,L-meso-diaminoheptanedioate
+
−
** M-DAP
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[DIAMINOPIMDECARB-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 ==
−
* [[DIAMINOPIMEPIM-RXN]]
+
* [[RXN-7657]]
 
== External links  ==
 
== External links  ==
−
* CAS : 922-54-3
 
−
* BIGG : 26dap__M
 
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=1549101 1549101]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6560 6560]
−
* LIGAND-CPD:
+
* CHEMSPIDER:
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** [http://www.genome.jp/dbget-bin/www_bget?C00680 C00680]
+
** [http://www.chemspider.com/Chemical-Structure.6312.html 6312]
 +
* HMDB : HMDB06006
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57791 57791]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=46645 46645]
−
* METABOLIGHTS : MTBLC57791
+
* LIGAND-CPD:
−
{{#set: smiles=C(C(CCCC(C([O-])=O)[N+])[N+])([O-])=O}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C14710 C14710]
−
{{#set: inchi key=InChIKey=GMKMEZVLHJARHF-SYDPRGILSA-N}}
+
{{#set: smiles=CC(C)CO}}
−
{{#set: common name=meso-diaminopimelate}}
+
{{#set: common name=isobutanol}}
−
{{#set: molecular weight=190.199   }}
+
{{#set: inchi key=InChIKey=ZXEKIIBDNHEJCQ-UHFFFAOYSA-N}}
−
{{#set: common name=meso-2,6-diaminopimelate|meso-A2pm|meso-diaminoheptanedioate|meso-2,6-diaminoheptanedioate|meso-1-α,ε-diaminopimelate|D,L-diaminopimelate|D,L-DAP|D,L-meso-diaminoheptanedioate|M-DAP}}
+
{{#set: molecular weight=74.122   }}
−
{{#set: consumed by=DIAMINOPIMDECARB-RXN}}
+
{{#set: common name=2-methyl-1-propanol|1-hydroxymethylpropane|2-methylpropanol|isobutyl alcohol}}
−
{{#set: reversible reaction associated=DIAMINOPIMEPIM-RXN}}
+
{{#set: reversible reaction associated=RXN-7657}}

Revision as of 16:20, 21 March 2018

Metabolite ISOBUTANOL

  • smiles:
    • CC(C)CO
  • common name:
    • isobutanol
  • inchi key:
    • InChIKey=ZXEKIIBDNHEJCQ-UHFFFAOYSA-N
  • molecular weight:
    • 74.122
  • Synonym(s):
    • 2-methyl-1-propanol
    • 1-hydroxymethylpropane
    • 2-methylpropanol
    • isobutyl alcohol

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links




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