Difference between revisions of "Ec-05 004950"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-9038 CPD-9038] == * smiles: ** CC3(C4(=CC5(=C(C(CCC([O-])=O)=C(CC1(=C(CCC([O-])=O)C(CC(=O)[...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-10283 CPD-10283] == * smiles: ** CCCCCCCCCCCCCCCCCCCC(=O)CC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-9038 CPD-9038] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-10283 CPD-10283] ==
 
* smiles:
 
* smiles:
−
** CC3(C4(=CC5(=C(C(CCC([O-])=O)=C(CC1(=C(CCC([O-])=O)C(CC(=O)[O-])=C(N1)CC2(NC(=C(CC([O-])=O)C=2CCC([O-])=O)CC(C3CCC(=O)[O-])=N4)))N5)CC([O-])=O)))(CC([O-])=O)
+
** CCCCCCCCCCCCCCCCCCCC(=O)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
−
* inchi key:
+
−
** InChIKey=CJLVUWULFKHGFB-NZCAJUPMSA-F
+
 
* common name:
 
* common name:
−
** precorrin-1
+
** 3-oxo-behenoyl-CoA
 +
* inchi key:
 +
** InChIKey=RKCOGGUHKPTOQJ-GNSUAQHMSA-J
 
* molecular weight:
 
* molecular weight:
−
** 842.768    
+
** 1100.059    
 
* Synonym(s):
 
* Synonym(s):
 +
** 3-oxo-docosanoyl-CoA
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN-8675]]
+
* [[RXN-13299]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[UROPORIIIMETHYLTRANSA-RXN]]
+
* [[RXN-13295]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25245954 25245954]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25203083 25203083]
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58893 58893]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=71451 71451]
−
* LIGAND-CPD:
+
{{#set: smiles=CCCCCCCCCCCCCCCCCCCC(=O)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}}
−
** [http://www.genome.jp/dbget-bin/www_bget?C15527 C15527]
+
{{#set: common name=3-oxo-behenoyl-CoA}}
−
{{#set: smiles=CC3(C4(=CC5(=C(C(CCC([O-])=O)=C(CC1(=C(CCC([O-])=O)C(CC(=O)[O-])=C(N1)CC2(NC(=C(CC([O-])=O)C=2CCC([O-])=O)CC(C3CCC(=O)[O-])=N4)))N5)CC([O-])=O)))(CC([O-])=O)}}
+
{{#set: inchi key=InChIKey=RKCOGGUHKPTOQJ-GNSUAQHMSA-J}}
−
{{#set: inchi key=InChIKey=CJLVUWULFKHGFB-NZCAJUPMSA-F}}
+
{{#set: molecular weight=1100.059   }}
−
{{#set: common name=precorrin-1}}
+
{{#set: common name=3-oxo-docosanoyl-CoA}}
−
{{#set: molecular weight=842.768   }}
+
{{#set: consumed by=RXN-13299}}
−
{{#set: consumed by=RXN-8675}}
+
{{#set: produced by=RXN-13295}}
−
{{#set: produced by=UROPORIIIMETHYLTRANSA-RXN}}
+

Revision as of 14:15, 21 March 2018

Metabolite CPD-10283

  • smiles:
    • CCCCCCCCCCCCCCCCCCCC(=O)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
  • common name:
    • 3-oxo-behenoyl-CoA
  • inchi key:
    • InChIKey=RKCOGGUHKPTOQJ-GNSUAQHMSA-J
  • molecular weight:
    • 1100.059
  • Synonym(s):
    • 3-oxo-docosanoyl-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCCCCCCCCCCCCCCCCCCC(=O)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.




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