Difference between revisions of "CPD0-2117"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD0-2117 CPD0-2117] == * smiles: ** CCCCCCCCCCCCCC=CC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-])(=O...")
 
Line 3: Line 3:
 
* smiles:
 
* smiles:
 
** CCCCCCCCCCCCCC=CC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OCC1(C(OP(=O)([O-])[O-])C(O)C(O1)N3(C=NC2(C(N)=NC=NC=23))))=O
 
** CCCCCCCCCCCCCC=CC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OCC1(C(OP(=O)([O-])[O-])C(O)C(O1)N3(C=NC2(C(N)=NC=NC=23))))=O
 +
* molecular weight:
 +
** 999.899   
 
* inchi key:
 
* inchi key:
 
** InChIKey=JUPAQFRKPHPXLD-MSHHSVQMSA-J
 
** InChIKey=JUPAQFRKPHPXLD-MSHHSVQMSA-J
 
* common name:
 
* common name:
 
** trans-hexadec-2-enoyl-CoA
 
** trans-hexadec-2-enoyl-CoA
* molecular weight:
 
** 999.899   
 
 
* Synonym(s):
 
* Synonym(s):
 
** trans-2-hexadecenoyl-CoA
 
** trans-2-hexadecenoyl-CoA
Line 18: Line 18:
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 +
* METABOLIGHTS : MTBLC61526
 
* BIGG : hdd2coa
 
* BIGG : hdd2coa
* PUBCHEM:
 
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=46173176 46173176]
 
* HMDB : HMDB03945
 
 
* LIGAND-CPD:
 
* LIGAND-CPD:
 
** [http://www.genome.jp/dbget-bin/www_bget?C05272 C05272]
 
** [http://www.genome.jp/dbget-bin/www_bget?C05272 C05272]
 +
* HMDB : HMDB03945
 
* CHEBI:
 
* CHEBI:
 
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=61526 61526]
 
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=61526 61526]
* METABOLIGHTS : MTBLC61526
+
* PUBCHEM:
 +
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=46173176 46173176]
 
{{#set: smiles=CCCCCCCCCCCCCC=CC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OCC1(C(OP(=O)([O-])[O-])C(O)C(O1)N3(C=NC2(C(N)=NC=NC=23))))=O}}
 
{{#set: smiles=CCCCCCCCCCCCCC=CC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OCC1(C(OP(=O)([O-])[O-])C(O)C(O1)N3(C=NC2(C(N)=NC=NC=23))))=O}}
 +
{{#set: molecular weight=999.899    }}
 
{{#set: inchi key=InChIKey=JUPAQFRKPHPXLD-MSHHSVQMSA-J}}
 
{{#set: inchi key=InChIKey=JUPAQFRKPHPXLD-MSHHSVQMSA-J}}
 
{{#set: common name=trans-hexadec-2-enoyl-CoA}}
 
{{#set: common name=trans-hexadec-2-enoyl-CoA}}
{{#set: molecular weight=999.899    }}
 
 
{{#set: common name=trans-2-hexadecenoyl-CoA|(2E)-hexadecenoyl-CoA}}
 
{{#set: common name=trans-2-hexadecenoyl-CoA|(2E)-hexadecenoyl-CoA}}
 
{{#set: consumed by=RXN-14272}}
 
{{#set: consumed by=RXN-14272}}

Latest revision as of 17:04, 9 January 2019

Metabolite CPD0-2117

  • smiles:
    • CCCCCCCCCCCCCC=CC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OCC1(C(OP(=O)([O-])[O-])C(O)C(O1)N3(C=NC2(C(N)=NC=NC=23))))=O
  • molecular weight:
    • 999.899
  • inchi key:
    • InChIKey=JUPAQFRKPHPXLD-MSHHSVQMSA-J
  • common name:
    • trans-hexadec-2-enoyl-CoA
  • Synonym(s):
    • trans-2-hexadecenoyl-CoA
    • (2E)-hexadecenoyl-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • METABOLIGHTS : MTBLC61526
  • BIGG : hdd2coa
  • LIGAND-CPD:
  • HMDB : HMDB03945
  • CHEBI:
  • PUBCHEM:
"CCCCCCCCCCCCCC=CC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OCC1(C(OP(=O)([O-])[O-])C(O)C(O1)N3(C=NC2(C(N)=NC=NC=23))))=O" cannot be used as a page name in this wiki.