Difference between revisions of "CPD-558"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7117 CPD-7117] == * smiles: ** C(O)C1(C(O)C(O)C(O)C(O1)OC3(C(C2(C=C(O)C(O)=C(O)C=2))=[O+]C4...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-558 CPD-558] == * smiles: ** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(CCCCCC([O-])=O)=O)COP(=O)(OP(=O)(...")
 
(One intermediate revision by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7117 CPD-7117] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-558 CPD-558] ==
 
* smiles:
 
* smiles:
** C(O)C1(C(O)C(O)C(O)C(O1)OC3(C(C2(C=C(O)C(O)=C(O)C=2))=[O+]C4(C(C=3)=C([O-])C=C([O-])C=4)))
+
** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(CCCCCC([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-]
* inchi key:
+
** InChIKey=XENHPQQLDPAYIJ-PEVLUNPASA-M
+
 
* common name:
 
* common name:
** delphinidin-3-O-β-D-glucoside
+
** pimeloyl-CoA
 +
* inchi key:
 +
** InChIKey=LYCRXMTYUZDUGA-UYRKPTJQSA-I
 
* molecular weight:
 
* molecular weight:
** 463.374    
+
** 904.649    
 
* Synonym(s):
 
* Synonym(s):
** delfinidin-3-O-glucoside
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** 6-carboxyhexanoyl-CoA
 +
** pimelyl-CoA
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-8228]]
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* [[7KAPSYN-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 ==
 
== External links  ==
 
== External links  ==
* LIPID_MAPS : LMPK12010278
 
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=102515359 102515359]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=45266589 45266589]
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=31463 31463]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57360 57360]
 +
* BIGG : pmcoa
 
* LIGAND-CPD:
 
* LIGAND-CPD:
** [http://www.genome.jp/dbget-bin/www_bget?C12138 C12138]
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** [http://www.genome.jp/dbget-bin/www_bget?C01063 C01063]
* HMDB : HMDB37997
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{{#set: smiles=CC(C)(C(O)C(=O)NCCC(=O)NCCSC(CCCCCC([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=C(O)C1(C(O)C(O)C(O)C(O1)OC3(C(C2(C=C(O)C(O)=C(O)C=2))=[O+]C4(C(C=3)=C([O-])C=C([O-])C=4)))}}
+
{{#set: common name=pimeloyl-CoA}}
{{#set: inchi key=InChIKey=XENHPQQLDPAYIJ-PEVLUNPASA-M}}
+
{{#set: inchi key=InChIKey=LYCRXMTYUZDUGA-UYRKPTJQSA-I}}
{{#set: common name=delphinidin-3-O-β-D-glucoside}}
+
{{#set: molecular weight=904.649   }}
{{#set: molecular weight=463.374   }}
+
{{#set: common name=6-carboxyhexanoyl-CoA|pimelyl-CoA}}
{{#set: common name=delfinidin-3-O-glucoside}}
+
{{#set: consumed by=7KAPSYN-RXN}}
{{#set: consumed by=RXN-8228}}
+

Latest revision as of 21:12, 21 March 2018

Metabolite CPD-558

  • smiles:
    • CC(C)(C(O)C(=O)NCCC(=O)NCCSC(CCCCCC([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-]
  • common name:
    • pimeloyl-CoA
  • inchi key:
    • InChIKey=LYCRXMTYUZDUGA-UYRKPTJQSA-I
  • molecular weight:
    • 904.649
  • Synonym(s):
    • 6-carboxyhexanoyl-CoA
    • pimelyl-CoA

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(CCCCCC([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.