Difference between revisions of "3-HYDROXYADIPYL-COA"

From metabolic_network
Jump to: navigation, search
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3-HYDROXYADIPYL-COA 3-HYDROXYADIPYL-COA] == * smiles: ** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(CC(CCC(=O...")
 
Line 3: Line 3:
 
* smiles:
 
* smiles:
 
** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(CC(CCC(=O)[O-])O)=O)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-]
 
** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(CC(CCC(=O)[O-])O)=O)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-]
 +
* molecular weight:
 +
** 906.621   
 
* inchi key:
 
* inchi key:
 
** InChIKey=OTEACGAEDCIMBS-NOTSHUFBSA-I
 
** InChIKey=OTEACGAEDCIMBS-NOTSHUFBSA-I
 
* common name:
 
* common name:
 
** (3S)-hydroxyadipyl-CoA
 
** (3S)-hydroxyadipyl-CoA
* molecular weight:
 
** 906.621   
 
 
* Synonym(s):
 
* Synonym(s):
  
Line 14: Line 14:
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
* [[RXN-2425]]
 
 
* [[RXN0-2044]]
 
* [[RXN0-2044]]
 +
* [[RXN-2425]]
 
== External links  ==
 
== External links  ==
* PUBCHEM:
 
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=70679061 70679061]
 
 
* CHEBI:
 
* CHEBI:
 
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=70990 70990]
 
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=70990 70990]
 +
* PUBCHEM:
 +
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=70679061 70679061]
 
* LIGAND-CPD:
 
* LIGAND-CPD:
 
** [http://www.genome.jp/dbget-bin/www_bget?C14145 C14145]
 
** [http://www.genome.jp/dbget-bin/www_bget?C14145 C14145]
 
* HMDB : HMDB12475
 
* HMDB : HMDB12475
 
{{#set: smiles=CC(C)(C(O)C(=O)NCCC(=O)NCCSC(CC(CCC(=O)[O-])O)=O)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=CC(C)(C(O)C(=O)NCCC(=O)NCCSC(CC(CCC(=O)[O-])O)=O)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: molecular weight=906.621    }}
 
{{#set: inchi key=InChIKey=OTEACGAEDCIMBS-NOTSHUFBSA-I}}
 
{{#set: inchi key=InChIKey=OTEACGAEDCIMBS-NOTSHUFBSA-I}}
 
{{#set: common name=(3S)-hydroxyadipyl-CoA}}
 
{{#set: common name=(3S)-hydroxyadipyl-CoA}}
{{#set: molecular weight=906.621    }}
+
{{#set: reversible reaction associated=RXN0-2044|RXN-2425}}
{{#set: reversible reaction associated=RXN-2425|RXN0-2044}}
+

Latest revision as of 18:01, 9 January 2019

Metabolite 3-HYDROXYADIPYL-COA

  • smiles:
    • CC(C)(C(O)C(=O)NCCC(=O)NCCSC(CC(CCC(=O)[O-])O)=O)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-]
  • molecular weight:
    • 906.621
  • inchi key:
    • InChIKey=OTEACGAEDCIMBS-NOTSHUFBSA-I
  • common name:
    • (3S)-hydroxyadipyl-CoA
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CC(C)(C(O)C(=O)NCCC(=O)NCCSC(CC(CCC(=O)[O-])O)=O)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-" cannot be used as a page name in this wiki.