| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:06 UTC |
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| Update Date | 2025-03-25 00:47:15 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02160422 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H7N3 |
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| Molecular Mass | 145.064 |
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| SMILES | Nc1ccc2ncncc2c1 |
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| InChI Key | XFGPXURFKAUHQR-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 | diazanaphthalenes |
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| Subclass | benzodiazines |
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| Direct Parent | quinazolinamines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsbenzenoidsdiazanaphthalenesheteroaromatic compoundshydrocarbon derivativesorganopnictogen compoundsprimary aminespyrimidines and pyrimidine derivatives |
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| Substituents | azacycleheteroaromatic compoundpyrimidinearomatic heteropolycyclic compoundorganonitrogen compoundquinazolinamineorganopnictogen compoundhydrocarbon derivativebenzenoidprimary amineorganic nitrogen compoundamine |
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