Difference between revisions of "CPD-7616"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=IMP IMP] == * smiles: ** C(OP(=O)([O-])[O-])C1(OC(C(O)C(O)1)N3(C=NC2(C(=O)NC=NC=23))) * inchi k...")
 
 
(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=IMP IMP] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7616 CPD-7616] ==
 
* smiles:
 
* smiles:
** C(OP(=O)([O-])[O-])C1(OC(C(O)C(O)1)N3(C=NC2(C(=O)NC=NC=23)))
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** C(C1(C=C(C(=CC=1)O)O))=O
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* molecular weight:
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** 138.123   
 
* inchi key:
 
* inchi key:
** InChIKey=GRSZFWQUAKGDAV-KQYNXXCUSA-L
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** InChIKey=IBGBGRVKPALMCQ-UHFFFAOYSA-N
 
* common name:
 
* common name:
** IMP
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** 3,4-dihydroxybenzaldehyde
* molecular weight:
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** 346.193   
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* Synonym(s):
 
* Synonym(s):
** 5'-IMP
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** protocatechualdehyde
** ribosylhypoxanthine monophosphate
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** 3,4-dihydroxybenzyl aldehyde
** inosinate
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** rancinamycin IV
** inosine monophosphate
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** inosine 5'-monophosphate
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** inosine 5'-phosphate
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** 5'-inosinate
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** 5'-inosinic acid
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** 5'-inosine monophosphate
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== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-7607]]
 
* [[ADENYLOSUCCINATE-SYNTHASE-RXN]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[AMP-DEAMINASE-RXN]]
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* [[RXN-8872]]
* [[HYPOXANPRIBOSYLTRAN-RXN]]
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* [[RXN-14003]]
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* [[RXN0-6382]]
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== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
* [[IMPCYCLOHYDROLASE-RXN]]
 
* [[IMP-DEHYDROG-RXN]]
 
 
== External links  ==
 
== External links  ==
* CAS : 131-99-7
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* CHEBI:
* METABOLIGHTS : MTBLC58053
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=50205 50205]
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=7140378 7140378]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=8768 8768]
* HMDB : HMDB00175
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* LIGAND-CPD:
 
* LIGAND-CPD:
** [http://www.genome.jp/dbget-bin/www_bget?C00130 C00130]
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** [http://www.genome.jp/dbget-bin/www_bget?C16700 C16700]
 
* CHEMSPIDER:
 
* CHEMSPIDER:
** [http://www.chemspider.com/Chemical-Structure.5482599.html 5482599]
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** [http://www.chemspider.com/Chemical-Structure.8438.html 8438]
* CHEBI:
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* HMDB : HMDB59965
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58053 58053]
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{{#set: smiles=C(C1(C=C(C(=CC=1)O)O))=O}}
* BIGG : imp
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{{#set: molecular weight=138.123   }}
{{#set: smiles=C(OP(=O)([O-])[O-])C1(OC(C(O)C(O)1)N3(C=NC2(C(=O)NC=NC=23)))}}
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{{#set: inchi key=InChIKey=IBGBGRVKPALMCQ-UHFFFAOYSA-N}}
{{#set: inchi key=InChIKey=GRSZFWQUAKGDAV-KQYNXXCUSA-L}}
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{{#set: common name=3,4-dihydroxybenzaldehyde}}
{{#set: common name=IMP}}
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{{#set: common name=protocatechualdehyde|3,4-dihydroxybenzyl aldehyde|rancinamycin IV}}
{{#set: molecular weight=346.193   }}
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{{#set: produced by=RXN-8872}}
{{#set: common name=5'-IMP|ribosylhypoxanthine monophosphate|inosinate|inosine monophosphate|inosine 5'-monophosphate|inosine 5'-phosphate|5'-inosinate|5'-inosinic acid|5'-inosine monophosphate}}
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{{#set: consumed by=RXN-7607|ADENYLOSUCCINATE-SYNTHASE-RXN}}
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{{#set: produced by=AMP-DEAMINASE-RXN|HYPOXANPRIBOSYLTRAN-RXN|RXN-14003|RXN0-6382}}
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{{#set: consumed or produced by=IMPCYCLOHYDROLASE-RXN|IMP-DEHYDROG-RXN}}
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Latest revision as of 15:35, 9 January 2019

Metabolite CPD-7616

  • smiles:
    • C(C1(C=C(C(=CC=1)O)O))=O
  • molecular weight:
    • 138.123
  • inchi key:
    • InChIKey=IBGBGRVKPALMCQ-UHFFFAOYSA-N
  • common name:
    • 3,4-dihydroxybenzaldehyde
  • Synonym(s):
    • protocatechualdehyde
    • 3,4-dihydroxybenzyl aldehyde
    • rancinamycin IV

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links