| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:15:06 UTC |
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| Update Date | 2025-03-25 00:59:14 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02235845 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H13NO3 |
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| Molecular Mass | 195.0895 |
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| SMILES | COc1cc2c(cc1O)C(CO)NC2 |
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| InChI Key | QNBFOBFBSMXLFF-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 | isoindoles and derivatives |
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| Subclass | isoindoles |
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| Direct Parent | isoindoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersanisolesazacyclic compoundsdialkylamineshydrocarbon derivativesisoindolinesorganopnictogen compoundsprimary alcohols |
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| Substituents | alcoholphenol ethersecondary aliphatic amineetherazacycleisoindole1-hydroxy-2-unsubstituted benzenoidalkyl aryl ethersecondary amineorganic oxygen compoundisoindolinearomatic heteropolycyclic compoundanisoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundprimary alcoholorganooxygen compoundamine |
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