| Record Information |
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| HMDB Status | quantified |
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| Creation Date | 2024-02-20 23:33:59 UTC |
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| Update Date | 2025-03-21 17:56:27 UTC |
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| HMDB ID | HMDB0000030 |
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| Metabolite Identification |
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| DeepMet ID | DMID00001432 |
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| Name | Biotin |
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| Frequency | 4162.1 |
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| Structure | |
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| Chemical Formula | C10H16N2O3S |
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| Molecular Mass | 244.0882 |
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| SMILES | O=C(O)CCCCC1SCC2NC(=O)NC21 |
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| InChI Key | YBJHBAHKTGYVGT-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | biotin and derivatives |
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| Subclass | biotin and derivatives |
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| Direct Parent | biotin and derivatives |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidsdialkylthioethersheterocyclic fatty acidshydrocarbon derivativesimidazolidinonesmedium-chain fatty acidsmonocarboxylic acids and derivativesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsthienoimidazolidinesthiolanesthiophenes |
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| Substituents | thiolaneimidazolidinefatty acylcarbonyl groupcarboxylic acidheterocyclic fatty acidfatty acidthiophenecarboxylic acid derivativealiphatic heteropolycyclic compoundimidazolidinoneorganic oxidebiotin_derivativeorganonitrogen compoundorganopnictogen compoundmedium-chain fatty acidcarbonic acid derivativeazacycledialkylthioetherbiotinthienoimidazolidinemonocarboxylic acid or derivativesorganic oxygen compoundthioetherhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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