Difference between revisions of "CPD-7146"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=DIMP DIMP] == * smiles: ** C(OP(=O)([O-])[O-])C1(OC(CC(O)1)N3(C=NC2(C(=O)NC=NC=23))) * inchi ke...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7146 CPD-7146] == * smiles: ** CC(CC1(OC(C=C(C=1)[O-])=O))C * inchi key: ** InChIKey=DFYHDD...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=DIMP DIMP] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7146 CPD-7146] ==
 
* smiles:
 
* smiles:
−
** C(OP(=O)([O-])[O-])C1(OC(CC(O)1)N3(C=NC2(C(=O)NC=NC=23)))
+
** CC(CC1(OC(C=C(C=1)[O-])=O))C
 
* inchi key:
 
* inchi key:
−
** InChIKey=PHNGFPPXDJJADG-RRKCRQDMSA-L
+
** InChIKey=DFYHDDCNKMPXMX-UHFFFAOYSA-M
 
* common name:
 
* common name:
−
** dIMP
+
** 6-isobutyl-4-hydroxy-2-pyrone
 
* molecular weight:
 
* molecular weight:
−
** 330.193    
+
** 167.184    
 
* Synonym(s):
 
* Synonym(s):
−
** 2'-deoxy-IMP
 
−
** 2'-deoxy-5'-inosinic acid
 
−
** 2'-Deoxyinosine 5'-monophosphate
 
−
** 2'-Deoxyinosine 5'-phosphate
 
−
** 9-(2-deoxy-5-O-phosphono-β-D-erythro-pentofuranosyl)-9H-purin-6-ol
 
−
** Deoxyinosine monophosphate
 
−
** Hypoxanthine deoxyriboside
 
  
 
== 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 ==
−
* [[RXN0-1602]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 +
* [[RXN-7825]]
 
== External links  ==
 
== External links  ==
−
* METABOLIGHTS : MTBLC61194
 
 
* PUBCHEM:
 
* PUBCHEM:
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=22841129 22841129]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25203460 25203460]
−
* HMDB : HMDB06555
+
{{#set: smiles=CC(CC1(OC(C=C(C=1)[O-])=O))C}}
−
* LIGAND-CPD:
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{{#set: inchi key=InChIKey=DFYHDDCNKMPXMX-UHFFFAOYSA-M}}
−
** [http://www.genome.jp/dbget-bin/www_bget?C06196 C06196]
+
{{#set: common name=6-isobutyl-4-hydroxy-2-pyrone}}
−
* CHEMSPIDER:
+
{{#set: molecular weight=167.184   }}
−
** [http://www.chemspider.com/Chemical-Structure.18596798.html 18596798]
+
{{#set: reversible reaction associated=RXN-7825}}
−
* CHEBI:
+
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=61194 61194]
+
−
* BIGG : dimp
+
−
{{#set: smiles=C(OP(=O)([O-])[O-])C1(OC(CC(O)1)N3(C=NC2(C(=O)NC=NC=23)))}}
+
−
{{#set: inchi key=InChIKey=PHNGFPPXDJJADG-RRKCRQDMSA-L}}
+
−
{{#set: common name=dIMP}}
+
−
{{#set: molecular weight=330.193   }}
+
−
{{#set: common name=2'-deoxy-IMP|2'-deoxy-5'-inosinic acid|2'-Deoxyinosine 5'-monophosphate|2'-Deoxyinosine 5'-phosphate|9-(2-deoxy-5-O-phosphono-β-D-erythro-pentofuranosyl)-9H-purin-6-ol|Deoxyinosine monophosphate|Hypoxanthine deoxyriboside}}
+
−
{{#set: produced by=RXN0-1602}}
+

Revision as of 17:00, 23 May 2018

Metabolite CPD-7146

  • smiles:
    • CC(CC1(OC(C=C(C=1)[O-])=O))C
  • inchi key:
    • InChIKey=DFYHDDCNKMPXMX-UHFFFAOYSA-M
  • common name:
    • 6-isobutyl-4-hydroxy-2-pyrone
  • molecular weight:
    • 167.184
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CC(CC1(OC(C=C(C=1)[O-])=O))C" cannot be used as a page name in this wiki.



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