| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:53:41 UTC |
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| Update Date | 2025-03-25 00:51:26 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02186942 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H7NO2S2 |
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| Molecular Mass | 212.9918 |
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| SMILES | NS(=O)(=O)c1ccc2ccsc2c1 |
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| InChI Key | ZHLYYXVKMXZBSJ-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 | benzothiophenes |
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| Subclass | 1-benzothiophenes |
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| Direct Parent | 1-benzothiophenes |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aminosulfonyl compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesorganic nitrogen compoundsorganic oxidesorganosulfonamidesthiophenes |
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| Substituents | organosulfonic acid or derivativesaminosulfonyl compoundheteroaromatic compoundthiopheneorganosulfur compoundorganosulfonic acid amideorganic oxidesulfonylorganic oxygen compoundaromatic heteropolycyclic compoundorganic sulfonic acid or derivatives1-benzothiophenehydrocarbon derivativebenzenoidorganic nitrogen compound |
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