| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 13:13:23 UTC |
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| Update Date | 2025-03-24 21:58:34 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01950943 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C8H7N |
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| Molecular Mass | 117.0578 |
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| SMILES | c1ccc2ccc=2[nH]c1 |
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| InChI Key | XPRXAZBGFIZIEI-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 | azepines |
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| Subclass | azepines |
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| Direct Parent | azepines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | azepineazacyclearomatic heteropolycyclic compoundheteroaromatic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compound |
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