| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:51:22 UTC |
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| Update Date | 2025-03-25 00:50:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02181638 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H14N2O3S |
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| Molecular Mass | 206.0725 |
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| SMILES | O=C(O)CCCNC(=S)NCCO |
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| InChI Key | XBYBOYJXJDXVHY-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | gamma amino acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alcohols and polyolsalkanolaminescarbonyl compoundscarboxylic acidshydrocarbon derivativeshydroxy fatty acidsmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsshort-chain hydroxy acids and derivativesstraight chain fatty acidsthioureas |
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| Substituents | alcoholfatty acylaliphatic acyclic compoundcarbonyl groupstraight chain fatty acidthioureacarboxylic acidshort-chain hydroxy acidgamma amino acid or derivativesfatty acidorganosulfur compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativehydroxy fatty acidorganic nitrogen compoundorganooxygen compoundalkanolamine |
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