Difference between revisions of "CPD-4203"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=DEHYDROQUINATE DEHYDROQUINATE] == * smiles: ** C1(C(O)C(O)C(=O)CC(O)(C([O-])=O)1) * inchi key:...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-4203 CPD-4203] == * smiles: ** CC(=CCNC3(=NC=NC2(N(C1(C(C(C(O1)COP(OP(=O)([O-])[O-])([O-])=...")
 
(2 intermediate revisions by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=DEHYDROQUINATE DEHYDROQUINATE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-4203 CPD-4203] ==
 
* smiles:
 
* smiles:
−
** C1(C(O)C(O)C(=O)CC(O)(C([O-])=O)1)
+
** CC(=CCNC3(=NC=NC2(N(C1(C(C(C(O1)COP(OP(=O)([O-])[O-])([O-])=O)O)O))C=NC=23)))C
−
* inchi key:
+
−
** InChIKey=WVMWZWGZRAXUBK-SYTVJDICSA-M
+
 
* common name:
 
* common name:
−
** 3-dehydroquinate
+
** N6-(Δ2-isopentenyl)-adenosine 5'-diphosphate
 +
* inchi key:
 +
** InChIKey=VXMXKDAHJURHEN-SDBHATRESA-K
 
* molecular weight:
 
* molecular weight:
−
** 189.144    
+
** 492.298    
 
* Synonym(s):
 
* Synonym(s):
−
** 3-dehydroquinic acid
+
** iPDP
−
** 5-dehydroquinic acid
+
** isopentenyladenosine riboside-5'-diphosphate
−
** 5-dehydroquinate
+
** iPRDP
−
** 5-de-H-quinate
+
** isopentenyladenosine-5'-diphosphate
−
** rel-(1R,3R,4S)-1,3,4-trihydroxy-5-oxocyclohexanecarboxylate
+
  
 
== 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 ==
−
* [[QUINATE-5-DEHYDROGENASE-RXN]]
+
* [[RXN-4305]]
−
* [[RXN-7967]]
+
−
* [[3-DEHYDROQUINATE-SYNTHASE-RXN]]
+
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[3-DEHYDROQUINATE-DEHYDRATASE-RXN]]
 
 
== External links  ==
 
== External links  ==
−
* CAS : 10534-44-8
 
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5460271 5460271]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25202829 25202829]
−
* HMDB : HMDB12710
+
−
* LIGAND-CPD:
+
−
** [http://www.genome.jp/dbget-bin/www_bget?C00944 C00944]
+
−
* CHEMSPIDER:
+
−
** [http://www.chemspider.com/Chemical-Structure.4573866.html 4573866]
+
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=32364 32364]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=73533 73533]
−
* BIGG : 3dhq
+
* LIGAND-CPD:
−
{{#set: smiles=C1(C(O)C(O)C(=O)CC(O)(C([O-])=O)1)}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C16426 C16426]
−
{{#set: inchi key=InChIKey=WVMWZWGZRAXUBK-SYTVJDICSA-M}}
+
{{#set: smiles=CC(=CCNC3(=NC=NC2(N(C1(C(C(C(O1)COP(OP(=O)([O-])[O-])([O-])=O)O)O))C=NC=23)))C}}
−
{{#set: common name=3-dehydroquinate}}
+
{{#set: common name=N6-(Δ2-isopentenyl)-adenosine 5'-diphosphate}}
−
{{#set: molecular weight=189.144   }}
+
{{#set: inchi key=InChIKey=VXMXKDAHJURHEN-SDBHATRESA-K}}
−
{{#set: common name=3-dehydroquinic acid|5-dehydroquinic acid|5-dehydroquinate|5-de-H-quinate|rel-(1R,3R,4S)-1,3,4-trihydroxy-5-oxocyclohexanecarboxylate}}
+
{{#set: molecular weight=492.298   }}
−
{{#set: produced by=QUINATE-5-DEHYDROGENASE-RXN|RXN-7967|3-DEHYDROQUINATE-SYNTHASE-RXN}}
+
{{#set: common name=iPDP|isopentenyladenosine riboside-5'-diphosphate|iPRDP|isopentenyladenosine-5'-diphosphate}}
−
{{#set: consumed or produced by=3-DEHYDROQUINATE-DEHYDRATASE-RXN}}
+
{{#set: produced by=RXN-4305}}

Latest revision as of 21:04, 21 March 2018

Metabolite CPD-4203

  • smiles:
    • CC(=CCNC3(=NC=NC2(N(C1(C(C(C(O1)COP(OP(=O)([O-])[O-])([O-])=O)O)O))C=NC=23)))C
  • common name:
    • N6-(Δ2-isopentenyl)-adenosine 5'-diphosphate
  • inchi key:
    • InChIKey=VXMXKDAHJURHEN-SDBHATRESA-K
  • molecular weight:
    • 492.298
  • Synonym(s):
    • iPDP
    • isopentenyladenosine riboside-5'-diphosphate
    • iPRDP
    • isopentenyladenosine-5'-diphosphate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CC(=CCNC3(=NC=NC2(N(C1(C(C(C(O1)COP(OP(=O)([O-])[O-])([O-])=O)O)O))C=NC=23)))C" cannot be used as a page name in this wiki.



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