Difference between revisions of "Ec-02 004080"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PROTOPORPHYRINOGEN PROTOPORPHYRINOGEN] == * smiles: ** C=CC1(=C5(NC(=C1C)CC2(=C(C(=C(N2)CC3(NC(...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17638 CPD-17638] == * smiles: ** CCCCCC(O)CCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PROTOPORPHYRINOGEN PROTOPORPHYRINOGEN] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17638 CPD-17638] ==
 
* smiles:
 
* smiles:
−
** C=CC1(=C5(NC(=C1C)CC2(=C(C(=C(N2)CC3(NC(=C(C=3CCC([O-])=O)C)CC4(=C(C(=C(N4)C5)C)C=C)))CCC(=O)[O-])C)))
+
** CCCCCC(O)CCCCCC(=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=UHSGPDMIQQYNAX-UHFFFAOYSA-L
+
** InChIKey=RXEDUSGPUQQZEW-XIRPNGCASA-J
 
* common name:
 
* common name:
−
** protoporphyrinogen IX
+
** 7-hydroxylauroyl-CoA
 
* molecular weight:
 
* molecular weight:
−
** 566.699    
+
** 961.807    
 
* Synonym(s):
 
* Synonym(s):
−
** protoporphyrinogen
+
** 7-hydroxydodecanoyl-CoA
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[PROTOPORGENOXI-RXN]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[RXN0-1461]]
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* [[RXN-12184]]
−
* [[HEMN-RXN]]
+
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
−
* CAS : 7412-77-3
 
−
* BIGG : 36764
 
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=20849104 20849104]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=91819849 91819849]
−
* HMDB : HMDB01097
+
{{#set: smiles=CCCCCC(O)CCCCCC(=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-]}}
−
* LIGAND-CPD:
+
{{#set: inchi key=InChIKey=RXEDUSGPUQQZEW-XIRPNGCASA-J}}
−
** [http://www.genome.jp/dbget-bin/www_bget?C01079 C01079]
+
{{#set: common name=7-hydroxylauroyl-CoA}}
−
* CHEMSPIDER:
+
{{#set: molecular weight=961.807   }}
−
** [http://www.chemspider.com/Chemical-Structure.20171538.html 20171538]
+
{{#set: common name=7-hydroxydodecanoyl-CoA}}
−
* CHEBI:
+
{{#set: produced by=RXN-12184}}
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57307 57307]
+
−
* METABOLIGHTS : MTBLC57307
+
−
{{#set: smiles=C=CC1(=C5(NC(=C1C)CC2(=C(C(=C(N2)CC3(NC(=C(C=3CCC([O-])=O)C)CC4(=C(C(=C(N4)C5)C)C=C)))CCC(=O)[O-])C)))}}
+
−
{{#set: inchi key=InChIKey=UHSGPDMIQQYNAX-UHFFFAOYSA-L}}
+
−
{{#set: common name=protoporphyrinogen IX}}
+
−
{{#set: molecular weight=566.699   }}
+
−
{{#set: common name=protoporphyrinogen}}
+
−
{{#set: consumed by=PROTOPORGENOXI-RXN}}
+
−
{{#set: produced by=RXN0-1461|HEMN-RXN}}
+

Revision as of 14:16, 21 March 2018

Metabolite CPD-17638

  • smiles:
    • CCCCCC(O)CCCCCC(=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=RXEDUSGPUQQZEW-XIRPNGCASA-J
  • common name:
    • 7-hydroxylauroyl-CoA
  • molecular weight:
    • 961.807
  • Synonym(s):
    • 7-hydroxydodecanoyl-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCCCCC(O)CCCCCC(=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.



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