Difference between revisions of "CPD0-2121"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17313 CPD-17313] == * smiles: ** CCCCCCCCCC=CCCCCC(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD0-2121 CPD0-2121] == * smiles: ** CCCC=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1...")
 
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17313 CPD-17313] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD0-2121 CPD0-2121] ==
 
* smiles:
 
* smiles:
** CCCCCCCCCC=CCCCCC(SCCNC(=O)CCNC(=O)C(O)C(C)(C)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-])=O
+
** CCCC=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)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-]
 
* inchi key:
 
* inchi key:
** InChIKey=PVZUHJMOMJKUEF-HATLACBZSA-J
+
** InChIKey=OINXHIBNZUUIMR-IXUYQXAASA-J
 
* common name:
 
* common name:
** sapienoyl-CoA
+
** trans-hex-2-enoyl-CoA
 
* molecular weight:
 
* molecular weight:
** 999.899    
+
** 859.631    
 
* Synonym(s):
 
* Synonym(s):
** Δ6-hexadecenoyl-CoA
+
** hexenoyl-CoA
** (6Z)-hexadec-6-enoyl-CoA
+
** (2E)-hexenoyl-CoA
** (6Z)-hexadecenoyl-CoA
+
** trans-2-hexenoyl-CoA
** 16:1, n-10, cis-6 hexadecenoyl-CoA
+
  
 
== 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-16065]]
+
* [[RXN-12567]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 +
* BIGG : 45472
 +
* LIPID_MAPS : LMFA07050019
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=71627261 71627261]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=52921640 52921640]
 +
* HMDB : HMDB03944
 +
* LIGAND-CPD:
 +
** [http://www.genome.jp/dbget-bin/www_bget?C05271 C05271]
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=74339 74339]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=62077 62077]
{{#set: smiles=CCCCCCCCCC=CCCCCC(SCCNC(=O)CCNC(=O)C(O)C(C)(C)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-])=O}}
+
* METABOLIGHTS : MTBLC28706
{{#set: inchi key=InChIKey=PVZUHJMOMJKUEF-HATLACBZSA-J}}
+
{{#set: smiles=CCCC=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)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: common name=sapienoyl-CoA}}
+
{{#set: inchi key=InChIKey=OINXHIBNZUUIMR-IXUYQXAASA-J}}
{{#set: molecular weight=999.899   }}
+
{{#set: common name=trans-hex-2-enoyl-CoA}}
{{#set: common name=Δ6-hexadecenoyl-CoA|(6Z)-hexadec-6-enoyl-CoA|(6Z)-hexadecenoyl-CoA|16:1, n-10, cis-6 hexadecenoyl-CoA}}
+
{{#set: molecular weight=859.631   }}
{{#set: produced by=RXN-16065}}
+
{{#set: common name=hexenoyl-CoA|(2E)-hexenoyl-CoA|trans-2-hexenoyl-CoA}}
 +
{{#set: produced by=RXN-12567}}

Latest revision as of 19:59, 21 March 2018

Metabolite CPD0-2121

  • smiles:
    • CCCC=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)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-]
  • inchi key:
    • InChIKey=OINXHIBNZUUIMR-IXUYQXAASA-J
  • common name:
    • trans-hex-2-enoyl-CoA
  • molecular weight:
    • 859.631
  • Synonym(s):
    • hexenoyl-CoA
    • (2E)-hexenoyl-CoA
    • trans-2-hexenoyl-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • BIGG : 45472
  • LIPID_MAPS : LMFA07050019
  • PUBCHEM:
  • HMDB : HMDB03944
  • LIGAND-CPD:
  • CHEBI:
  • METABOLIGHTS : MTBLC28706
"CCCC=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)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.