Showing metabocard for Dethiobiotin (MMDBc0029726)

Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-11-17 23:39:09 UTC
Update Date2024-10-13 09:38:29 UTC
Metabolite IDMMDBc0029726
Metabolite Identification
Common NameDethiobiotin
DescriptionDethiobiotin is a synthetic metabolite that mimic the effects of biotin on gene expression and thus have biotin-like activities. It is an intermediate in biotin metabolism, and converted to biotin via biotin synthase (EC:2.8.1.6). (KEGG) Biotin serves as a coenzyme for carboxylases such as propionyl-CoA carboxylase. (PMID 12730407 )
Structure
MOLSDFPDBSMILESInChI

MOL for #<Metabolite:0x00007fab0e188218>

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3D MOL for #<Metabolite:0x00007fab0e188218>
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3D SDF for #<Metabolite:0x00007fab0e188218>
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3D-SDF for #<Metabolite:0x00007fab0e188218>
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PDB for #<Metabolite:0x00007fab0e188218>
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3D PDB for #<Metabolite:0x00007fab0e188218>
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SMILES for #<Metabolite:0x00007fab0e188218>
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INCHI for #<Metabolite:0x00007fab0e188218>
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Synonyms
ValueSource
(+)-DethiobiotinChEBI
(4R,5S)-5-Methyl-2-oxo-4-imidazolidinehexanoic acidChEBI
(4R-cis)-5-Methyl-2-oxo-4-imidazolidinehexanoic acidChEBI
D-DethiobiotinChEBI
DesthiobiotinChEBI
(4R,5S)-5-Methyl-2-oxo-4-imidazolidinehexanoateGenerator
(4R-cis)-5-Methyl-2-oxo-4-imidazolidinehexanoateGenerator
Desthiobiotin, (4R-cis)-isomerMeSH
Desthiobiotin, (cis)-(+-)-isomerMeSH
4-Methyl-5-(omega-carboxyamyl)imidazolidone-2HMDB
4-Methyl-5-(ω-carboxyamyl)imidazolidone-2HMDB
5-Methyl-2-oxo-4-imidazolidinecaproic acidHMDB
DethiobiotinHMDB
epsilon-(4-Methyl-5-imidazolidone-2)caproic acidHMDB
ε-(4-Methyl-5-imidazolidone-2)caproic acidHMDB
Molecular FormulaC10H18N2O3
Average Mass214.2615
Monoisotopic Mass214.131742452
IUPAC NameNot Available
Traditional NameNot Available
CAS Registry Number533-48-2
SMILESNot Available
InChI Identifier
InChI=1S/C10H18N2O3/c1-7-8(12-10(15)11-7)5-3-2-4-6-9(13)14/h7-8H,2-6H2,1H3,(H,13,14)(H2,11,12,15)/t7-,8+/m0/s1
InChI KeyAUTOLBMXDDTRRT-JGVFFNPUSA-N