Difference between revisions of "CPD-12175"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CARBON-DIOXIDE CARBON-DIOXIDE] == * smiles: ** C(=O)=O * inchi key: ** InChIKey=CURLTUGMZLYLDI-...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-12175 CPD-12175] == * smiles: ** CC(C([O-])=O)CO * inchi key: ** InChIKey=DBXBTMSZEOQQDU-VK...")
 
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CARBON-DIOXIDE CARBON-DIOXIDE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-12175 CPD-12175] ==
 
* smiles:
 
* smiles:
** C(=O)=O
+
** CC(C([O-])=O)CO
 
* inchi key:
 
* inchi key:
** InChIKey=CURLTUGMZLYLDI-UHFFFAOYSA-N
+
** InChIKey=DBXBTMSZEOQQDU-VKHMYHEASA-M
 
* common name:
 
* common name:
** CO2
+
** (S)-3-hydroxy-isobutanoate
 
* molecular weight:
 
* molecular weight:
** 44.01    
+
** 103.097    
 
* Synonym(s):
 
* Synonym(s):
** carbonic anhydride
+
** (S)-3-hydroxy-2-methylpropanoate
** carbonic acid gas
+
** (S)-3-Hydroxyisobutyric acid
** carbon dioxide
+
** (S)-3-OH-iso-but
 +
** (S)-3-OH-isobutyrate
 +
** (S)-3-hydroxy-isobutyrate
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[DETHIOBIOTIN-SYN-RXN]]
+
* [[3-HYDROXYISOBUTYRATE-DEHYDROGENASE-RXN]]
* [[TransportSeed_CARBON-DIOXIDE]]
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* [[RIBULOSE-BISPHOSPHATE-CARBOXYLASE-RXN]]
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* [[AIRCARBOXY-RXN]]
+
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-16615]]
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* [[3-HYDROXYISOBUTYRYL-COA-HYDROLASE-RXN]]
* [[UDP-GLUCURONATE-DECARBOXYLASE-RXN]]
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* [[RXN0-1461]]
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* [[RXN-10828]]
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* [[PREPHENATEDEHYDROG-RXN]]
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* [[QUINOPRIBOTRANS-RXN]]
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* [[N-CARBAMOYLPUTRESCINE-AMIDASE-RXN]]
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* [[2.3.1.179-RXN]]
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* [[RXN-11210]]
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* [[SAMDECARB-RXN]]
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* [[1.14.11.2-RXN]]
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* [[UROGENDECARBOX-RXN]]
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* [[RXN0-2141]]
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* [[RXN-13158]]
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* [[RXN-3142]]
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* [[TransportSeed_CARBON-DIOXIDE]]
+
* [[PYFLAVOXRE-RXN]]
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* [[PEPCARBOXYKIN-RXN]]
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* [[RXN-9539]]
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* [[RXN-9535]]
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* [[RXN-6201]]
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* [[ORNDECARBOX-RXN]]
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* [[BETA-UREIDOPROPIONASE-RXN]]
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* [[RXN-7645]]
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* [[NARINGENIN-CHALCONE-SYNTHASE-RXN]]
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* [[ACETOOHBUTSYN-RXN]]
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* [[RXN1G-445]]
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* [[RXN-7648]]
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* [[P-PANTOCYSDECARB-RXN]]
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* [[RXN66-23]]
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* [[KETOISOCAPROATE-RXN]]
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* [[RXN1G-368]]
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* [[RXN490-3641]]
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* [[RXN-10734]]
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* [[RXN-9632]]
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* [[SERINE-C-PALMITOYLTRANSFERASE-RXN]]
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* [[RXN-9523]]
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* [[DIPHOSPHOMEVALONTE-DECARBOXYLASE-RXN]]
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* [[RXN-9527]]
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* [[RXN-16079]]
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* [[RXN-113]]
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* [[RXN-9952]]
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* [[RXN-7800]]
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* [[ACETOLACTSYN-RXN]]
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* [[RXN-10815]]
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* [[RXN-5682]]
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* [[6PGLUCONDEHYDROG-RXN]]
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* [[RXN-9648]]
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* [[MALONYL-COA-DECARBOXYLASE-RXN]]
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* [[RXN-7790]]
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* [[2-KETO-ADIPATE-DEHYDROG-RXN]]
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* [[RXN-12539]]
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* [[RXN-7775]]
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* [[OXALODECARB-RXN]]
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* [[RXN-13431]]
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* [[RXN-16081]]
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* [[RXN-16082]]
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* [[RXN0-5222]]
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* [[RXN-6081]]
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* [[7KAPSYN-RXN]]
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* [[MALIC-NADP-RXN]]
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* [[TYROSINE-DECARBOXYLASE-RXN]]
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* [[4-HYDROXYPHENYLPYRUVATE-DIOXYGENASE-RXN]]
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* [[RXN-9654]]
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* [[RXN-2902]]
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* [[RXN-14972]]
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* [[RXN-115]]
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* [[RXN-9531]]
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* [[RXN-9653]]
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* [[RXN-9652]]
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* [[RXN-9651]]
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* [[RXN-9650]]
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* [[PYRUVDEH-RXN]]
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* [[HEMN-RXN]]
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* [[2KETO-4METHYL-PENTANOATE-DEHYDROG-RXN]]
+
* [[RXN-10658]]
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* [[NARINGENIN-3-DIOXYGENASE-RXN]]
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* [[2OXOGLUTARATEDEH-RXN]]
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* [[RXN-16629]]
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* [[RXN-11403]]
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* [[RXN-10654]]
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* [[RXN-16094]]
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* [[RXN-16621]]
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* [[RXN66-470]]
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* [[RXN-16625]]
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* [[RXN-3341]]
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* [[2OXOGLUTDECARB-RXN]]
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* [[RXN-13295]]
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* [[RXN-602]]
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* [[1.1.1.39-RXN]]
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* [[RXN-16016]]
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* [[RXN1G-499]]
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* [[IGPSYN-RXN]]
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* [[RXN66-18]]
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* [[PEPTIDE-ASPARTATE-BETA-DIOXYGENASE-RXN]]
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* [[RXN1F-93]]
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* [[RXN0-1134]]
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* [[RXN-6550]]
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* [[1.14.11.18-RXN]]
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* [[1.2.1.25-RXN]]
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* [[RXN-11474]]
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* [[ARGININE-2-MONOOXYGENASE-RXN]]
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* [[RXN-11479]]
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* [[RXN-12583]]
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* [[DIAMINOPIMDECARB-RXN]]
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* [[RXN-527]]
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* [[DXS-RXN]]
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* [[OROTPDECARB-RXN]]
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* [[RXN-11484]]
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* [[3-OXOACYL-ACP-SYNTH-BASE-RXN]]
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* [[RXN-13442]]
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* [[RXN-171]]
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* [[RXN-8450]]
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* [[RXN-5641]]
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* [[RXN-7745]]
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* [[RXN-10059]]
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* [[RXN-2541]]
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* [[RXN-7922]]
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* [[CYCLOHEXADIENYL-DEHYDROGENASE-RXN]]
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* [[RXN66-313]]
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* [[RXN66-318]]
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* [[3-OXOACYL-ACP-SYNTH-RXN]]
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* [[HISTIDINE-DECARBOXYLASE-RXN]]
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* [[RXN-14986]]
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* [[RXN3O-1803]]
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* [[RXN1F-168]]
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* [[RXN1F-162]]
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* [[RXN-13322]]
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* [[RXN1F-165]]
+
* [[RXN1F-167]]
+
* [[RXN-9516]]
+
* [[RXN1F-163]]
+
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
* [[ISOCITDEH-RXN]]
 
* [[RXN0-5224]]
 
* [[GCVMULTI-RXN]]
 
* [[2.3.1.41-RXN]]
 
* [[RXN-13926]]
 
* [[CARBODEHYDRAT-RXN]]
 
* [[1.1.1.170-RXN]]
 
* [[RXN1G-460]]
 
* [[PREPHENATEDEHYDRAT-RXN]]
 
* [[RXN-8349_PLANTCYC]]
 
* [[FATTY-ACID-SYNTHASE-RXN]]
 
* [[ExchangeSeed_CARBON-DIOXIDE]]
 
* [[PREPHENATE-DEHYDROGENASE-NADP+-RXN]]
 
* [[1.2.4.4-RXN]]
 
* [[2KETO-3METHYLVALERATE-RXN]]
 
* [[PYRUFLAVREDUCT-RXN]]
 
* [[FATTY-ACYL-COA-SYNTHASE-RXN]]
 
* [[2.7.8.23-RXN]]
 
* [[RXN-8642]]
 
* [[RXN-1744]]
 
* [[RXN-14476]]
 
* [[GCVMULTI-RXN-GLY/THF/NAD//METHYLENE-THF/AMMONIUM/CARBON-DIOXIDE/NADH.56.]]
 
* [[GCVP-RXN]]
 
* [[RXN-10642]]
 
* [[METHYLVALERATE-RXN]]
 
* [[CARBAMATE-KINASE-RXN]]
 
 
== External links  ==
 
== External links  ==
* UM-BBD-CPD : c0131
 
* CAS : 124-38-9
 
* BIGG : 33506
 
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=280 280]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=18637352 18637352]
* HMDB : HMDB01967
+
* LIGAND-CPD:
+
** [http://www.genome.jp/dbget-bin/www_bget?C00011 C00011]
+
* CHEMSPIDER:
+
** [http://www.chemspider.com/Chemical-Structure.274.html 274]
+
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16526 16526]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=62638 62638]
* METABOLIGHTS : MTBLC16526
+
* LIGAND-CPD:
{{#set: smiles=C(=O)=O}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C06001 C06001]
{{#set: inchi key=InChIKey=CURLTUGMZLYLDI-UHFFFAOYSA-N}}
+
* HMDB : HMDB00023
{{#set: common name=CO2}}
+
{{#set: smiles=CC(C([O-])=O)CO}}
{{#set: molecular weight=44.01   }}
+
{{#set: inchi key=InChIKey=DBXBTMSZEOQQDU-VKHMYHEASA-M}}
{{#set: common name=carbonic anhydride|carbonic acid gas|carbon dioxide}}
+
{{#set: common name=(S)-3-hydroxy-isobutanoate}}
{{#set: consumed by=DETHIOBIOTIN-SYN-RXN|TransportSeed_CARBON-DIOXIDE|RIBULOSE-BISPHOSPHATE-CARBOXYLASE-RXN|AIRCARBOXY-RXN}}
+
{{#set: molecular weight=103.097   }}
{{#set: produced by=RXN-16615|UDP-GLUCURONATE-DECARBOXYLASE-RXN|RXN0-1461|RXN-10828|PREPHENATEDEHYDROG-RXN|QUINOPRIBOTRANS-RXN|N-CARBAMOYLPUTRESCINE-AMIDASE-RXN|2.3.1.179-RXN|RXN-11210|SAMDECARB-RXN|1.14.11.2-RXN|UROGENDECARBOX-RXN|RXN0-2141|RXN-13158|RXN-3142|TransportSeed_CARBON-DIOXIDE|PYFLAVOXRE-RXN|PEPCARBOXYKIN-RXN|RXN-9539|RXN-9535|RXN-6201|ORNDECARBOX-RXN|BETA-UREIDOPROPIONASE-RXN|RXN-7645|NARINGENIN-CHALCONE-SYNTHASE-RXN|ACETOOHBUTSYN-RXN|RXN1G-445|RXN-7648|P-PANTOCYSDECARB-RXN|RXN66-23|KETOISOCAPROATE-RXN|RXN1G-368|RXN490-3641|RXN-10734|RXN-9632|SERINE-C-PALMITOYLTRANSFERASE-RXN|RXN-9523|DIPHOSPHOMEVALONTE-DECARBOXYLASE-RXN|RXN-9527|RXN-16079|RXN-113|RXN-9952|RXN-7800|ACETOLACTSYN-RXN|RXN-10815|RXN-5682|6PGLUCONDEHYDROG-RXN|RXN-9648|MALONYL-COA-DECARBOXYLASE-RXN|RXN-7790|2-KETO-ADIPATE-DEHYDROG-RXN|RXN-12539|RXN-7775|OXALODECARB-RXN|RXN-13431|RXN-16081|RXN-16082|RXN0-5222|RXN-6081|7KAPSYN-RXN|MALIC-NADP-RXN|TYROSINE-DECARBOXYLASE-RXN|4-HYDROXYPHENYLPYRUVATE-DIOXYGENASE-RXN|RXN-9654|RXN-2902|RXN-14972|RXN-115|RXN-9531|RXN-9653|RXN-9652|RXN-9651|RXN-9650|PYRUVDEH-RXN|HEMN-RXN|2KETO-4METHYL-PENTANOATE-DEHYDROG-RXN|RXN-10658|NARINGENIN-3-DIOXYGENASE-RXN|2OXOGLUTARATEDEH-RXN|RXN-16629|RXN-11403|RXN-10654|RXN-16094|RXN-16621|RXN66-470|RXN-16625|RXN-3341|2OXOGLUTDECARB-RXN|RXN-13295|RXN-602|1.1.1.39-RXN|RXN-16016|RXN1G-499|IGPSYN-RXN|RXN66-18|PEPTIDE-ASPARTATE-BETA-DIOXYGENASE-RXN|RXN1F-93|RXN0-1134|RXN-6550|1.14.11.18-RXN|1.2.1.25-RXN|RXN-11474|ARGININE-2-MONOOXYGENASE-RXN|RXN-11479|RXN-12583|DIAMINOPIMDECARB-RXN|RXN-527|DXS-RXN|OROTPDECARB-RXN|RXN-11484|3-OXOACYL-ACP-SYNTH-BASE-RXN|RXN-13442|RXN-171|RXN-8450|RXN-5641|RXN-7745|RXN-10059|RXN-2541|RXN-7922|CYCLOHEXADIENYL-DEHYDROGENASE-RXN|RXN66-313|RXN66-318|3-OXOACYL-ACP-SYNTH-RXN|HISTIDINE-DECARBOXYLASE-RXN|RXN-14986|RXN3O-1803|RXN1F-168|RXN1F-162|RXN-13322|RXN1F-165|RXN1F-167|RXN-9516|RXN1F-163}}
+
{{#set: common name=(S)-3-hydroxy-2-methylpropanoate|(S)-3-Hydroxyisobutyric acid|(S)-3-OH-iso-but|(S)-3-OH-isobutyrate|(S)-3-hydroxy-isobutyrate}}
{{#set: reversible reaction associated=ISOCITDEH-RXN|RXN0-5224|GCVMULTI-RXN|2.3.1.41-RXN|RXN-13926|CARBODEHYDRAT-RXN|1.1.1.170-RXN|RXN1G-460|PREPHENATEDEHYDRAT-RXN|RXN-8349_PLANTCYC|FATTY-ACID-SYNTHASE-RXN|ExchangeSeed_CARBON-DIOXIDE|PREPHENATE-DEHYDROGENASE-NADP+-RXN|1.2.4.4-RXN|2KETO-3METHYLVALERATE-RXN|PYRUFLAVREDUCT-RXN|FATTY-ACYL-COA-SYNTHASE-RXN|2.7.8.23-RXN|RXN-8642|RXN-1744|RXN-14476|GCVMULTI-RXN-GLY/THF/NAD//METHYLENE-THF/AMMONIUM/CARBON-DIOXIDE/NADH.56.|GCVP-RXN|RXN-10642|METHYLVALERATE-RXN|CARBAMATE-KINASE-RXN}}
+
{{#set: consumed by=3-HYDROXYISOBUTYRATE-DEHYDROGENASE-RXN}}
 +
{{#set: produced by=3-HYDROXYISOBUTYRYL-COA-HYDROLASE-RXN}}

Latest revision as of 19:51, 21 March 2018

Metabolite CPD-12175

  • smiles:
    • CC(C([O-])=O)CO
  • inchi key:
    • InChIKey=DBXBTMSZEOQQDU-VKHMYHEASA-M
  • common name:
    • (S)-3-hydroxy-isobutanoate
  • molecular weight:
    • 103.097
  • Synonym(s):
    • (S)-3-hydroxy-2-methylpropanoate
    • (S)-3-Hydroxyisobutyric acid
    • (S)-3-OH-iso-but
    • (S)-3-OH-isobutyrate
    • (S)-3-hydroxy-isobutyrate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

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