| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:16:53 UTC |
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| Update Date | 2025-03-21 18:34:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00102701 |
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| Frequency | 26.5 |
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| Structure | |
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| Chemical Formula | C12H15N3O3S |
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| Molecular Mass | 281.0834 |
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| SMILES | CC(=O)NCCc1c[nH]c2ccc(S(N)(=O)=O)cc12 |
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| InChI Key | UGHUQNNBKNXCFC-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 | indoles and derivatives |
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| Subclass | indoles |
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| Direct Parent | indoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | acetamidesaminosulfonyl compoundsazacyclic compoundsbenzenoidscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsorganosulfonamidespyrrolessecondary carboxylic acid amides |
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| Substituents | organosulfonic acid or derivativescarbonyl groupindoleorganosulfur compoundcarboxylic acid derivativeorganosulfonic acid amideorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundacetamideazacycleaminosulfonyl compoundheteroaromatic compoundcarboxamide groupsecondary carboxylic acid amidesulfonylorganic oxygen compoundorganic sulfonic acid or derivativespyrrolehydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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