Difference between revisions of "CPD-14596"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=COUMARIN COUMARIN] == * smiles: ** C1(OC2(=CC=CC=C(C=C1)2))=O * inchi key: ** InChIKey=ZYGHJZDH...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ADENOSYL-P4 ADENOSYL-P4] == * smiles: ** C(C1(C(C(C(O1)N3(C=NC2(C(=NC=NC=23)N)))O)O))OP(OP(OP(O...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=COUMARIN COUMARIN] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ADENOSYL-P4 ADENOSYL-P4] ==
 
* smiles:
 
* smiles:
** C1(OC2(=CC=CC=C(C=C1)2))=O
+
** C(C1(C(C(C(O1)N3(C=NC2(C(=NC=NC=23)N)))O)O))OP(OP(OP(OP(OCC4(C(C(C(O4)N6(C=NC5(C(=NC=NC=56)N)))O)O))([O-])=O)([O-])=O)([O-])=O)([O-])=O
 
* inchi key:
 
* inchi key:
** InChIKey=ZYGHJZDHTFUPRJ-UHFFFAOYSA-N
+
** InChIKey=YOAHKNVSNCMZGQ-XPWFQUROSA-J
 
* common name:
 
* common name:
** coumarin
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** 5',5'''-diadenosine tetraphosphate
 
* molecular weight:
 
* molecular weight:
** 146.145    
+
** 832.36    
 
* Synonym(s):
 
* Synonym(s):
** cumarin
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** Ap4A
** 1,2-benzopyrone
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** AppppA
 +
** P(1),P(4)-bis(5'-adenosyl)tetraphosphate
 +
** P1,P4-bis(5'-adenosyl)tetraphosphate
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-8037]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 +
* [[ATP-ADENYLYLTRANSFERASE-RXN]]
 
== External links  ==
 
== External links  ==
* DRUGBANK : DB04665
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* BIGG : 1484745
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=323 323]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25243905 25243905]
* HMDB : HMDB01218
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* HMDB : HMDB01211
 
* LIGAND-CPD:
 
* LIGAND-CPD:
** [http://www.genome.jp/dbget-bin/www_bget?C05851 C05851]
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** [http://www.genome.jp/dbget-bin/www_bget?C01260 C01260]
* CHEMSPIDER:
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** [http://www.chemspider.com/Chemical-Structure.13848793.html 13848793]
+
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=28794 28794]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58141 58141]
* METABOLIGHTS : MTBLC28794
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* METABOLIGHTS : MTBLC58141
{{#set: smiles=C1(OC2(=CC=CC=C(C=C1)2))=O}}
+
{{#set: smiles=C(C1(C(C(C(O1)N3(C=NC2(C(=NC=NC=23)N)))O)O))OP(OP(OP(OP(OCC4(C(C(C(O4)N6(C=NC5(C(=NC=NC=56)N)))O)O))([O-])=O)([O-])=O)([O-])=O)([O-])=O}}
{{#set: inchi key=InChIKey=ZYGHJZDHTFUPRJ-UHFFFAOYSA-N}}
+
{{#set: inchi key=InChIKey=YOAHKNVSNCMZGQ-XPWFQUROSA-J}}
{{#set: common name=coumarin}}
+
{{#set: common name=5',5'''-diadenosine tetraphosphate}}
{{#set: molecular weight=146.145   }}
+
{{#set: molecular weight=832.36   }}
{{#set: common name=cumarin|1,2-benzopyrone}}
+
{{#set: common name=Ap4A|AppppA|P(1),P(4)-bis(5'-adenosyl)tetraphosphate|P1,P4-bis(5'-adenosyl)tetraphosphate}}
{{#set: produced by=RXN-8037}}
+
{{#set: reversible reaction associated=ATP-ADENYLYLTRANSFERASE-RXN}}

Revision as of 14:58, 21 March 2018

Metabolite ADENOSYL-P4

  • smiles:
    • C(C1(C(C(C(O1)N3(C=NC2(C(=NC=NC=23)N)))O)O))OP(OP(OP(OP(OCC4(C(C(C(O4)N6(C=NC5(C(=NC=NC=56)N)))O)O))([O-])=O)([O-])=O)([O-])=O)([O-])=O
  • inchi key:
    • InChIKey=YOAHKNVSNCMZGQ-XPWFQUROSA-J
  • common name:
    • 5',5-diadenosine tetraphosphate
  • molecular weight:
    • 832.36
  • Synonym(s):
    • Ap4A
    • AppppA
    • P(1),P(4)-bis(5'-adenosyl)tetraphosphate
    • P1,P4-bis(5'-adenosyl)tetraphosphate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • BIGG : 1484745
  • PUBCHEM:
  • HMDB : HMDB01211
  • LIGAND-CPD:
  • CHEBI:
  • METABOLIGHTS : MTBLC58141
"C(C1(C(C(C(O1)N3(C=NC2(C(=NC=NC=23)N)))O)O))OP(OP(OP(OP(OCC4(C(C(C(O4)N6(C=NC5(C(=NC=NC=56)N)))O)O))([O-])=O)([O-])=O)([O-])=O)([O-])=O" cannot be used as a page name in this wiki.