| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:13:54 UTC |
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| Update Date | 2025-03-25 00:58:49 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02233042 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H16N2O |
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| Molecular Mass | 204.1263 |
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| SMILES | CCC(C)C(O)c1nc2ccccc2[nH]1 |
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| InChI Key | QBBSIVWYRXDRCZ-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 | benzimidazoles |
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| Subclass | benzimidazoles |
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| Direct Parent | benzimidazoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aromatic alcoholsazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesimidazolesorganonitrogen compoundsorganopnictogen compoundssecondary alcohols |
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| Substituents | aromatic alcoholalcoholazacycleheteroaromatic compoundorganic oxygen compoundaromatic heteropolycyclic compoundbenzimidazoleimidazoleorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compoundazole |
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