| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:58:03 UTC |
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| Update Date | 2025-03-21 18:05:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00057521 |
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| Frequency | 61.0 |
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| Structure | |
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| Chemical Formula | C10H9NO |
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| Molecular Mass | 159.0684 |
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| SMILES | Cc1c[nH]c(=O)c2ccccc12 |
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| InChI Key | QTMDNWRHSMJECC-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 | isoquinolines and derivatives |
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| Subclass | isoquinolones and derivatives |
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| Direct Parent | isoquinolones and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridinespyridines and derivativespyridinones |
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| Substituents | lactamazacyclepolyhalopyridineheteroaromatic compoundorganic oxidepyridineorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundisoquinolonehydrocarbon derivativebenzenoidorganic nitrogen compoundpyridinoneorganooxygen compound |
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