| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:38:48 UTC |
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| Update Date | 2025-03-25 00:46:03 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02153002 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H9NOS |
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| Molecular Mass | 227.0405 |
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| SMILES | NC(=O)c1cccc2c1sc1ccccc12 |
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| InChI Key | NUGMEQRGXGSBJI-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 | dibenzothiophenes |
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| Direct Parent | dibenzothiophenes |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-benzothiophenesbenzenoidscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsprimary carboxylic acid amidesthiophenes |
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| Substituents | primary carboxylic acid amidedibenzothiopheneheteroaromatic compoundthiophenecarboxamide groupcarboxylic acid derivativeorganic oxideorganic oxygen compoundaromatic heteropolycyclic compound1-benzothiopheneorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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