Difference between revisions of "CPD-18353"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=UTP UTP] == * smiles: ** C(OP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])C1(OC(C(O)C(O)1)N2(C=CC(=O)...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3-HYDROXY-3-METHYL-GLUTARYL-COA 3-HYDROXY-3-METHYL-GLUTARYL-COA] == * smiles: ** CC(C)(C(O)C(=O...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=UTP UTP] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3-HYDROXY-3-METHYL-GLUTARYL-COA 3-HYDROXY-3-METHYL-GLUTARYL-COA] ==
 
* smiles:
 
* smiles:
−
** C(OP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])C1(OC(C(O)C(O)1)N2(C=CC(=O)NC(=O)2))
+
** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CC(C)(O)CC(=O)[O-])COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-]
 
* inchi key:
 
* inchi key:
−
** InChIKey=PGAVKCOVUIYSFO-XVFCMESISA-J
+
** InChIKey=CABVTRNMFUVUDM-VRHQGPGLSA-I
 
* common name:
 
* common name:
−
** UTP
+
** (S)-3-hydroxy-3-methylglutaryl-CoA
 
* molecular weight:
 
* molecular weight:
−
** 480.112    
+
** 906.621    
 
* Synonym(s):
 
* Synonym(s):
−
** uridine-triphosphate
+
** 3-hydroxy-3-methyl-glutaryl-CoA
−
** uridine-5'-triphosphate
+
** HMG-CoA
 +
** hydroxymethylglutaryl-CoA
 +
** 3-hydroxy-3-methylglutaryl-coenzyme A
 +
** 3-Hydroxy-3-methylglutaryl-CoA
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN-12199]]
+
* [[HYDROXYMETHYLGLUTARYL-COA-LYASE-RXN]]
−
* [[RXN-14325]]
+
−
* [[RXN-14139]]
+
−
* [[RXN-12196]]
+
−
* [[CTPSYN-RXN]]
+
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[UDPKIN-RXN]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[UTPHEXPURIDYLYLTRANS-RXN]]
+
* [[1.1.1.34-RXN]]
−
* [[GLUC1PURIDYLTRANS-RXN]]
+
* [[HYDROXYMETHYLGLUTARYL-COA-REDUCTASE-RXN]]
 +
* [[HYDROXYMETHYLGLUTARYL-COA-SYNTHASE-RXN]]
 
== External links  ==
 
== External links  ==
−
* CAS : 63-39-8
+
* CAS : 1553-55-5
−
* METABOLIGHTS : MTBLC46398
+
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=7058168 7058168]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5288565 5288565]
−
* HMDB : HMDB00285
+
−
* LIGAND-CPD:
+
−
** [http://www.genome.jp/dbget-bin/www_bget?C00075 C00075]
+
−
* CHEMSPIDER:
+
−
** [http://www.chemspider.com/Chemical-Structure.5414500.html 5414500]
+
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=46398 46398]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=43074 43074]
−
* BIGG : utp
+
* LIGAND-CPD:
−
{{#set: smiles=C(OP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])C1(OC(C(O)C(O)1)N2(C=CC(=O)NC(=O)2))}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C00356 C00356]
−
{{#set: inchi key=InChIKey=PGAVKCOVUIYSFO-XVFCMESISA-J}}
+
* HMDB : HMDB01375
−
{{#set: common name=UTP}}
+
{{#set: smiles=CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CC(C)(O)CC(=O)[O-])COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-]}}
−
{{#set: molecular weight=480.112   }}
+
{{#set: inchi key=InChIKey=CABVTRNMFUVUDM-VRHQGPGLSA-I}}
−
{{#set: common name=uridine-triphosphate|uridine-5'-triphosphate}}
+
{{#set: common name=(S)-3-hydroxy-3-methylglutaryl-CoA}}
−
{{#set: consumed by=RXN-12199|RXN-14325|RXN-14139|RXN-12196|CTPSYN-RXN}}
+
{{#set: molecular weight=906.621   }}
−
{{#set: produced by=UDPKIN-RXN}}
+
{{#set: common name=3-hydroxy-3-methyl-glutaryl-CoA|HMG-CoA|hydroxymethylglutaryl-CoA|3-hydroxy-3-methylglutaryl-coenzyme A|3-Hydroxy-3-methylglutaryl-CoA}}
−
{{#set: consumed or produced by=UTPHEXPURIDYLYLTRANS-RXN|GLUC1PURIDYLTRANS-RXN}}
+
{{#set: consumed by=HYDROXYMETHYLGLUTARYL-COA-LYASE-RXN}}
 +
{{#set: consumed or produced by=1.1.1.34-RXN|HYDROXYMETHYLGLUTARYL-COA-REDUCTASE-RXN|HYDROXYMETHYLGLUTARYL-COA-SYNTHASE-RXN}}

Revision as of 11:12, 18 January 2018

Metabolite 3-HYDROXY-3-METHYL-GLUTARYL-COA

  • smiles:
    • CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CC(C)(O)CC(=O)[O-])COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-]
  • inchi key:
    • InChIKey=CABVTRNMFUVUDM-VRHQGPGLSA-I
  • common name:
    • (S)-3-hydroxy-3-methylglutaryl-CoA
  • molecular weight:
    • 906.621
  • Synonym(s):
    • 3-hydroxy-3-methyl-glutaryl-CoA
    • HMG-CoA
    • hydroxymethylglutaryl-CoA
    • 3-hydroxy-3-methylglutaryl-coenzyme A
    • 3-Hydroxy-3-methylglutaryl-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CC(C)(O)CC(=O)[O-])COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-" cannot be used as a page name in this wiki.




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