| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 13:45:54 UTC |
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| Update Date | 2025-03-24 22:12:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02028638 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C6H5N3O |
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| Molecular Mass | 135.0433 |
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| SMILES | O=c1[nH]ncc2c[nH]cc12 |
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| InChI Key | LWCPMBCQKVMGKW-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 | pyrrolo[3,4-d]pyridazines |
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| Subclass | pyrrolo[3,4-d]pyridazines |
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| Direct Parent | pyrrolo[3,4-d]pyridazines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyridazinonespyrrolesvinylogous amides |
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| Substituents | vinylogous amidelactamazacycleheteroaromatic compoundpyrrolo[3,4-d]pyridazineorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundpyridazinepyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativepyridazinoneorganic nitrogen compoundorganooxygen compound |
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