| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:21:03 UTC |
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| Update Date | 2025-03-25 01:01:28 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02249521 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H15NOS |
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| Molecular Mass | 221.0874 |
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| SMILES | Cc1c(CCS(C)=O)[nH]c2ccccc12 |
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| InChI Key | ALCNROYZYLIYBB-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 | 3-methylindoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesindolesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolessulfinyl compoundssulfoxides |
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| Substituents | 3-methylindoleazacycleheteroaromatic compoundorganosulfur compoundorganic oxideorganic oxygen compoundsulfinyl compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundsulfoxideorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compound |
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