| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:59:13 UTC |
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| Update Date | 2025-03-25 00:53:24 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02199443 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H10N2 |
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| Molecular Mass | 182.0844 |
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| SMILES | Cc1ccc2ccc3nc[nH]c3c2c1 |
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| InChI Key | JTSMIMFODHIWMR-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | naphthalenes |
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| Subclass | naphthalenes |
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| Direct Parent | naphthalenes |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsbenzimidazolesheteroaromatic compoundshydrocarbon derivativesimidazolesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | azacycleheteroaromatic compoundnaphthalenearomatic heteropolycyclic compoundbenzimidazoleimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundazole |
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