| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:00:14 UTC |
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| Update Date | 2025-03-25 00:53:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02201791 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H13NO |
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| Molecular Mass | 187.0997 |
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| SMILES | Cc1ccc2c(C)c(C)[nH]c2c(=O)c1 |
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| InChI Key | FGQQZJYZYHYRRA-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | hydrocarbon derivatives |
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| Class | tropones |
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| Subclass | tropones |
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| Direct Parent | tropones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundsorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyrroles |
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| Substituents | troponeazacycleheteroaromatic compoundorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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