| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 16:45:32 UTC |
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| Update Date | 2025-03-25 01:33:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02445186 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H7NO |
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| Molecular Mass | 133.0528 |
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| SMILES | OC1=CC2=CC=CC(=C1)N2 |
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| InChI Key | PVRGUOMVSYYLOS-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 | pyridines and derivatives |
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| Subclass | hydropyridines |
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| Direct Parent | dihydropyridines |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsdialkylamineshydrocarbon derivativesorganooxygen compoundsorganopnictogen compounds |
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| Substituents | secondary aliphatic amineazacyclesecondary aminealiphatic heteropolycyclic compoundorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compounddihydropyridineorganooxygen compoundamine |
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