| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:10:05 UTC |
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| Update Date | 2025-03-25 00:57:25 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02224643 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H9NO3S |
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| Molecular Mass | 199.0303 |
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| SMILES | NS(=O)(=O)c1cccc2c1CCO2 |
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| InChI Key | XPOOABCSJWQRPM-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 | coumarans |
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| Subclass | coumarans |
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| Direct Parent | coumarans |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersaminosulfonyl compoundsbenzenoidshydrocarbon derivativesorganic nitrogen compoundsorganic oxidesorganosulfonamidesoxacyclic compounds |
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| Substituents | organosulfonic acid or derivativesetheraminosulfonyl compoundalkyl aryl etherorganosulfur compoundorganosulfonic acid amideoxacycleorganic oxidesulfonylorganic oxygen compoundaromatic heteropolycyclic compoundorganic sulfonic acid or derivativeshydrocarbon derivativebenzenoidorganic nitrogen compoundcoumaranorganooxygen compound |
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