Difference between revisions of "PWY-7128"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11519 CPD-11519] == * smiles: ** CCC=CCC4(C(=O)CCC(CCCCCC(O)CC(SCCNC(=O)CCNC(=O)C(O)C(C)(C)...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=UROPORPHYRINOGEN-III UROPORPHYRINOGEN-III] == * smiles: ** C(=O)([O-])CCC3(C(=C2(CC5(NC(CC4(NC(...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11519 CPD-11519] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=UROPORPHYRINOGEN-III UROPORPHYRINOGEN-III] ==
 
* smiles:
 
* smiles:
** CCC=CCC4(C(=O)CCC(CCCCCC(O)CC(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)4)
+
** C(=O)([O-])CCC3(C(=C2(CC5(NC(CC4(NC(CC1(NC(=C(C=1CC(=O)[O-])CCC(=O)[O-])CC(N2)=3))=C(CC(=O)[O-])C=4CCC(=O)[O-]))=C(CC([O-])=O)C(CCC(=O)[O-])=5)))CC(=O)[O-])
 
* inchi key:
 
* inchi key:
** InChIKey=PDDHCVXPABQISO-PEUIIYGWSA-J
+
** InChIKey=HUHWZXWWOFSFKF-UHFFFAOYSA-F
 
* common name:
 
* common name:
** OPC8-3-hydroxyacyl-CoA
+
** uroporphyrinogen-III
 
* molecular weight:
 
* molecular weight:
** 1055.92    
+
** 828.742    
 
* Synonym(s):
 
* Synonym(s):
** 3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-octa-3-hydroxy-2-enoyl-CoA
+
** uroporphyrinogen III
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-10698]]
+
* [[RXN-13403]]
 +
* [[UROPORIIIMETHYLTRANSA-RXN]]
 +
* [[UROGENDECARBOX-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-10697]]
+
* [[UROGENIIISYN-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 +
* CAS : 1976-85-8
 +
* BIGG : 36704
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=44237307 44237307]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25202645 25202645]
{{#set: smiles=CCC=CCC4(C(=O)CCC(CCCCCC(O)CC(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)4)}}
+
* HMDB : HMDB01086
{{#set: inchi key=InChIKey=PDDHCVXPABQISO-PEUIIYGWSA-J}}
+
* LIGAND-CPD:
{{#set: common name=OPC8-3-hydroxyacyl-CoA}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C01051 C01051]
{{#set: molecular weight=1055.92   }}
+
* CHEBI:
{{#set: common name=3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-octa-3-hydroxy-2-enoyl-CoA}}
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57308 57308]
{{#set: consumed by=RXN-10698}}
+
* METABOLIGHTS : MTBLC57308
{{#set: produced by=RXN-10697}}
+
{{#set: smiles=C(=O)([O-])CCC3(C(=C2(CC5(NC(CC4(NC(CC1(NC(=C(C=1CC(=O)[O-])CCC(=O)[O-])CC(N2)=3))=C(CC(=O)[O-])C=4CCC(=O)[O-]))=C(CC([O-])=O)C(CCC(=O)[O-])=5)))CC(=O)[O-])}}
 +
{{#set: inchi key=InChIKey=HUHWZXWWOFSFKF-UHFFFAOYSA-F}}
 +
{{#set: common name=uroporphyrinogen-III}}
 +
{{#set: molecular weight=828.742   }}
 +
{{#set: common name=uroporphyrinogen III}}
 +
{{#set: consumed by=RXN-13403|UROPORIIIMETHYLTRANSA-RXN|UROGENDECARBOX-RXN}}
 +
{{#set: produced by=UROGENIIISYN-RXN}}

Revision as of 20:58, 17 March 2018

Metabolite UROPORPHYRINOGEN-III

  • smiles:
    • C(=O)([O-])CCC3(C(=C2(CC5(NC(CC4(NC(CC1(NC(=C(C=1CC(=O)[O-])CCC(=O)[O-])CC(N2)=3))=C(CC(=O)[O-])C=4CCC(=O)[O-]))=C(CC([O-])=O)C(CCC(=O)[O-])=5)))CC(=O)[O-])
  • inchi key:
    • InChIKey=HUHWZXWWOFSFKF-UHFFFAOYSA-F
  • common name:
    • uroporphyrinogen-III
  • molecular weight:
    • 828.742
  • Synonym(s):
    • uroporphyrinogen III

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 1976-85-8
  • BIGG : 36704
  • PUBCHEM:
  • HMDB : HMDB01086
  • LIGAND-CPD:
  • CHEBI:
  • METABOLIGHTS : MTBLC57308
"C(=O)([O-])CCC3(C(=C2(CC5(NC(CC4(NC(CC1(NC(=C(C=1CC(=O)[O-])CCC(=O)[O-])CC(N2)=3))=C(CC(=O)[O-])C=4CCC(=O)[O-]))=C(CC([O-])=O)C(CCC(=O)[O-])=5)))CC(=O)[O-])" cannot be used as a page name in this wiki.