| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:18:15 UTC |
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| Update Date | 2025-03-21 18:35:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00106040 |
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| Frequency | 34.4 |
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| Structure | |
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| Chemical Formula | C11H12N2 |
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| Molecular Mass | 172.1 |
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| SMILES | c1ccc(CCc2c[nH]cn2)cc1 |
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| InChI Key | UFVVSLRERVDQAI-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | benzene and substituted derivatives |
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| Direct Parent | benzene and substituted derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | monocyclic benzene moietyaromatic heteromonocyclic compoundazacycleheteroaromatic compoundimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundazole |
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