| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:52:02 UTC |
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| Update Date | 2025-03-25 00:50:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02183121 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H12O2S |
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| Molecular Mass | 184.0558 |
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| SMILES | O=[SH](=O)CCCc1ccccc1 |
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| InChI Key | OJZGYBRUTPKEGZ-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 | benzene and substituted derivatives |
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| Direct Parent | benzene and substituted derivatives |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alkylthiolshydrocarbon derivativesorganic oxidesorganosulfur compoundss-alkylsulfenates |
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| Substituents | aromatic homomonocyclic compounds-alkylsulfenatemonocyclic benzene moietyorganic oxideorganic oxygen compoundhydrocarbon derivativeorganosulfur compoundalkylthiol |
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