| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:21:48 UTC |
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| Update Date | 2025-03-21 18:37:15 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00114733 |
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| Frequency | 33.3 |
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| Structure | |
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| Chemical Formula | C8H6N2O2 |
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| Molecular Mass | 162.0429 |
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| SMILES | O=C(O)c1ccc2[nH]ncc2c1 |
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| InChI Key | MAVGBUDLHOOROM-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 | benzopyrazoles |
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| Subclass | indazoles |
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| Direct Parent | indazoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsbenzenoidscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyrazoles |
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| Substituents | carboxylic acidazacycleindazoleheteroaromatic compoundcarboxylic acid derivativepyrazoleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundbenzopyrazoleorganooxygen compoundazole |
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