| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:26:33 UTC |
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| Update Date | 2025-03-21 18:39:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00125951 |
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| Frequency | 20.3 |
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| Structure | |
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| Chemical Formula | C8H12N2O2S |
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| Molecular Mass | 200.0619 |
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| SMILES | NCCS(=O)(=O)c1ccc(N)cc1 |
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| InChI Key | UXSCNZAJAXNSBW-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 | benzenesulfonyl compounds |
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| Direct Parent | benzenesulfonyl compounds |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | hydrocarbon derivativesmonoalkylaminesorganic oxidesorganopnictogen compoundssulfones |
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| Substituents | organosulfur compoundaromatic homomonocyclic compoundorganic oxidesulfonylorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineprimary amineorganic nitrogen compoundaminesulfonebenzenesulfonyl group |
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