Difference between revisions of "CPD-12897"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-19150 CPD-19150] == * smiles: ** CCCCCCC=CCC=CC(=O)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=CPD-12897 CPD-12897] == * smiles: ** CC(C)=CCCC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP...")
 
(2 intermediate revisions by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-19150 CPD-19150] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-12897 CPD-12897] ==
 
* smiles:
 
* smiles:
** CCCCCCC=CCC=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-]
+
** CC(C)=CCCC(=O)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=ZSJRXHRCABOSNC-SHJPOGNXSA-J
+
** InChIKey=LPMIXVANMSEERY-FUEUKBNZSA-J
 
* common name:
 
* common name:
** (2E,5Z)-dodecenoyl-CoA
+
** 7-methyl-3-oxooct-6-enoyl-CoA
 
* molecular weight:
 
* molecular weight:
** 941.776    
+
** 915.695    
 
* Synonym(s):
 
* Synonym(s):
** 12:2-Δ2,Δ5-CoA
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** 7-methyl-3-oxo-6-octenoyl-CoA
** 2-trans,5-cis-dodecenoyl-CoA
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-17797]]
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* [[RXN-11917]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-17796]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
{{#set: smiles=CCCCCCC=CCC=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-]}}
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* PUBCHEM:
{{#set: inchi key=InChIKey=ZSJRXHRCABOSNC-SHJPOGNXSA-J}}
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=50986200 50986200]
{{#set: common name=(2E,5Z)-dodecenoyl-CoA}}
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* CHEBI:
{{#set: molecular weight=941.776   }}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=71410 71410]
{{#set: common name=12:2-Δ2,Δ5-CoA|2-trans,5-cis-dodecenoyl-CoA}}
+
* LIGAND-CPD:
{{#set: consumed by=RXN-17797}}
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** [http://www.genome.jp/dbget-bin/www_bget?C16466 C16466]
{{#set: produced by=RXN-17796}}
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* HMDB : HMDB60421
 +
{{#set: smiles=CC(C)=CCCC(=O)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: inchi key=InChIKey=LPMIXVANMSEERY-FUEUKBNZSA-J}}
 +
{{#set: common name=7-methyl-3-oxooct-6-enoyl-CoA}}
 +
{{#set: molecular weight=915.695   }}
 +
{{#set: common name=7-methyl-3-oxo-6-octenoyl-CoA}}
 +
{{#set: consumed by=RXN-11917}}

Latest revision as of 19:40, 21 March 2018

Metabolite CPD-12897

  • smiles:
    • CC(C)=CCCC(=O)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=LPMIXVANMSEERY-FUEUKBNZSA-J
  • common name:
    • 7-methyl-3-oxooct-6-enoyl-CoA
  • molecular weight:
    • 915.695
  • Synonym(s):
    • 7-methyl-3-oxo-6-octenoyl-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CC(C)=CCCC(=O)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.