| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:05:16 UTC |
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| Update Date | 2025-03-25 00:55:39 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02213548 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H15NO3S2 |
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| Molecular Mass | 261.0493 |
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| SMILES | CNCC(O)c1ccc(OSSC)c(O)c1 |
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| InChI Key | CGBOHXRTTIHKOP-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | phenoxy compounds |
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| Direct Parent | phenoxy compounds |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsaromatic alcoholsdialkylamineshydrocarbon derivativesorganopnictogen compoundssecondary alcoholssulfenyl compounds |
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| Substituents | aromatic alcoholalcoholsecondary aliphatic aminesulfenyl compound1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidsecondary amineorganosulfur compoundaromatic homomonocyclic compoundorganic oxygen compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundphenolhydrocarbon derivativeorganic nitrogen compoundphenoxy compoundorganooxygen compoundamine |
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