| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:09:10 UTC |
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| Update Date | 2025-03-25 00:57:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02222577 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H7NO3S |
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| Molecular Mass | 233.0147 |
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| SMILES | O=C1Nc2ccc(S(=O)O)c3cccc1c23 |
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| InChI Key | CIFMENNVXULQMZ-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 | isoindoles and derivatives |
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| Subclass | isoindolines |
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| Direct Parent | isoindolones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundscarboxylic acids and derivativeshydrocarbon derivativesindolesisoindoleslactamsnaphthalenesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsorganosulfur compoundssecondary carboxylic acid amidessulfinic acids |
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| Substituents | lactamindolesulfinic acid derivativeorganosulfur compoundcarboxylic acid derivativesulfinic acidisoindoloneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundazacycleisoindoleindole or derivativescarboxamide groupsecondary carboxylic acid amidenaphthaleneorganic oxygen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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