Difference between revisions of "RXN-9384"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PHOSPHORYL-ETHANOLAMINE PHOSPHORYL-ETHANOLAMINE] == * smiles: ** C(C[N+])OP([O-])([O-])=O * inc...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=6-DEMETHYLSTERIGMATOCYSTIN 6-DEMETHYLSTERIGMATOCYSTIN] == * smiles: ** C5(=C[CH]4(C3(=C(C=C(C2(...")
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PHOSPHORYL-ETHANOLAMINE PHOSPHORYL-ETHANOLAMINE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=6-DEMETHYLSTERIGMATOCYSTIN 6-DEMETHYLSTERIGMATOCYSTIN] ==
 
* smiles:
 
* smiles:
−
** C(C[N+])OP([O-])([O-])=O
+
** C5(=C[CH]4(C3(=C(C=C(C2(C(C1(C(=CC=CC=1OC=23)O))=O))O)O[CH]4O5)))
−
* inchi key:
+
−
** InChIKey=SUHOOTKUPISOBE-UHFFFAOYSA-M
+
 
* common name:
 
* common name:
−
** O-phosphoethanolamine
+
** 6-demethylsterigmatocystin
 +
* inchi key:
 +
** InChIKey=RQQOEIJLJPCYJR-BWKAKNAASA-N
 
* molecular weight:
 
* molecular weight:
−
** 140.055    
+
** 310.262    
 
* Synonym(s):
 
* Synonym(s):
−
** phosphoryl-ethanolamine
 
−
** O-phosphorylethanolamine
 
−
** phosphoethanolamine
 
−
** ethanolamine phosphate
 
−
** 2-aminoethyl phosphate
 
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[2.7.7.14-RXN]]
+
* [[2.1.1.109-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[SPHINGANINE-1-PHOSPHATE-ALDOLASE-RXN]]
 
−
* [[SGPL11]]
 
−
* [[RXN3DJ-11230]]
 
−
* [[RXN-13729]]
 
−
* [[ETHANOLAMINE-KINASE-RXN]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[ETHANOLAMINE-PHOSPHATE-PHOSPHO-LYASE-RXN]]
 
 
== External links  ==
 
== External links  ==
−
* CAS : 1071-23-4
+
* LIPID_MAPS : LMPK10000002
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=7059434 7059434]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5280620 5280620]
−
* HMDB : HMDB00224
+
* HMDB : HMDB33657
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C00346 C00346]
+
** [http://www.genome.jp/dbget-bin/www_bget?C03683 C03683]
 
* CHEMSPIDER:
 
* CHEMSPIDER:
−
** [http://www.chemspider.com/Chemical-Structure.5415641.html 5415641]
+
** [http://www.chemspider.com/Chemical-Structure.4444228.html 4444228]
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58190 58190]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=18236 18236]
−
* METABOLIGHTS : MTBLC58190
+
* METABOLIGHTS : MTBLC18236
−
{{#set: smiles=C(C[N+])OP([O-])([O-])=O}}
+
{{#set: smiles=C5(=C[CH]4(C3(=C(C=C(C2(C(C1(C(=CC=CC=1OC=23)O))=O))O)O[CH]4O5)))}}
−
{{#set: inchi key=InChIKey=SUHOOTKUPISOBE-UHFFFAOYSA-M}}
+
{{#set: common name=6-demethylsterigmatocystin}}
−
{{#set: common name=O-phosphoethanolamine}}
+
{{#set: inchi key=InChIKey=RQQOEIJLJPCYJR-BWKAKNAASA-N}}
−
{{#set: molecular weight=140.055   }}
+
{{#set: molecular weight=310.262   }}
−
{{#set: common name=phosphoryl-ethanolamine|O-phosphorylethanolamine|phosphoethanolamine|ethanolamine phosphate|2-aminoethyl phosphate}}
+
{{#set: consumed by=2.1.1.109-RXN}}
−
{{#set: consumed by=2.7.7.14-RXN}}
+
−
{{#set: produced by=SPHINGANINE-1-PHOSPHATE-ALDOLASE-RXN|SGPL11|RXN3DJ-11230|RXN-13729|ETHANOLAMINE-KINASE-RXN}}
+
−
{{#set: reversible reaction associated=ETHANOLAMINE-PHOSPHATE-PHOSPHO-LYASE-RXN}}
+

Revision as of 16:33, 21 March 2018

Metabolite 6-DEMETHYLSTERIGMATOCYSTIN

  • smiles:
    • C5(=C[CH]4(C3(=C(C=C(C2(C(C1(C(=CC=CC=1OC=23)O))=O))O)O[CH]4O5)))
  • common name:
    • 6-demethylsterigmatocystin
  • inchi key:
    • InChIKey=RQQOEIJLJPCYJR-BWKAKNAASA-N
  • molecular weight:
    • 310.262
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • LIPID_MAPS : LMPK10000002
  • PUBCHEM:
  • HMDB : HMDB33657
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC18236
"C5(=C[CH]4(C3(=C(C=C(C2(C(C1(C(=CC=CC=1OC=23)O))=O))O)O[CH]4O5)))" cannot be used as a page name in this wiki.



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