Difference between revisions of "SECOLOGANIN-CPD"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-15301 CPD-15301] == * smiles: ** CC(C)CCCC(C)CCCC(C)CCCC(C)CCCC(C)CCCC(C)CCC2(C(SC)=C(O)C1(...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=SECOLOGANIN-CPD SECOLOGANIN-CPD] == * smiles: ** C=C[CH]1(C(OC=C(C(=O)OC)[CH](CC=O)1)OC2(OC(CO)...")
 
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-15301 CPD-15301] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=SECOLOGANIN-CPD SECOLOGANIN-CPD] ==
 
* smiles:
 
* smiles:
** CC(C)CCCC(C)CCCC(C)CCCC(C)CCCC(C)CCCC(C)CCC2(C(SC)=C(O)C1(=C(SC=C1)C(O)=2))
+
** C=C[CH]1(C(OC=C(C(=O)OC)[CH](CC=O)1)OC2(OC(CO)C(O)C(O)C(O)2))
 
* inchi key:
 
* inchi key:
** InChIKey=UVCQOKDZGIAHDG-UHFFFAOYSA-N
+
** InChIKey=CSKKDSFETGLMSB-NRZPKYKESA-N
 
* common name:
 
* common name:
** caldariellaquinol
+
** secologanin
 
* molecular weight:
 
* molecular weight:
** 633.085    
+
** 388.371    
 
* Synonym(s):
 
* Synonym(s):
 +
** (-)-secologanin
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[STRICTOSIDINE-SYNTHASE-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-14451]]
 
* [[RXN-15378]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
* LIGAND-CPD:
+
* LIPID_MAPS : LMPR0102070002
** [http://www.genome.jp/dbget-bin/www_bget?C20623 C20623]
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* CHEBI:
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=73388 73388]
+
* METABOLIGHTS : MTBLC73388
+
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=71464569 71464569]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=161276 161276]
{{#set: smiles=CC(C)CCCC(C)CCCC(C)CCCC(C)CCCC(C)CCCC(C)CCC2(C(SC)=C(O)C1(=C(SC=C1)C(O)=2))}}
+
* CHEMSPIDER:
{{#set: inchi key=InChIKey=UVCQOKDZGIAHDG-UHFFFAOYSA-N}}
+
** [http://www.chemspider.com/Chemical-Structure.141670.html 141670]
{{#set: common name=caldariellaquinol}}
+
* CHEBI:
{{#set: molecular weight=633.085   }}
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=18002 18002]
{{#set: produced by=RXN-14451|RXN-15378}}
+
* LIGAND-CPD:
 +
** [http://www.genome.jp/dbget-bin/www_bget?C01852 C01852]
 +
{{#set: smiles=C=C[CH]1(C(OC=C(C(=O)OC)[CH](CC=O)1)OC2(OC(CO)C(O)C(O)C(O)2))}}
 +
{{#set: inchi key=InChIKey=CSKKDSFETGLMSB-NRZPKYKESA-N}}
 +
{{#set: common name=secologanin}}
 +
{{#set: molecular weight=388.371   }}
 +
{{#set: common name=(-)-secologanin}}
 +
{{#set: consumed by=STRICTOSIDINE-SYNTHASE-RXN}}

Latest revision as of 19:38, 21 March 2018

Metabolite SECOLOGANIN-CPD

  • smiles:
    • C=C[CH]1(C(OC=C(C(=O)OC)[CH](CC=O)1)OC2(OC(CO)C(O)C(O)C(O)2))
  • inchi key:
    • InChIKey=CSKKDSFETGLMSB-NRZPKYKESA-N
  • common name:
    • secologanin
  • molecular weight:
    • 388.371
  • Synonym(s):
    • (-)-secologanin

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"C=C[CH]1(C(OC=C(C(=O)OC)[CH](CC=O)1)OC2(OC(CO)C(O)C(O)C(O)2))" cannot be used as a page name in this wiki.