| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:53:52 UTC |
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| Update Date | 2025-03-21 18:04:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00047850 |
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| Frequency | 69.4 |
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| Structure | |
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| Chemical Formula | C7H12N2 |
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| Molecular Mass | 124.1 |
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| SMILES | CNCCc1ccc[nH]1 |
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| InChI Key | BLNYFIUYVKPUGM-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 | heteroaromatic compounds |
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| Subclass | heteroaromatic compounds |
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| Direct Parent | heteroaromatic compounds |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsdialkylamineshydrocarbon derivativesorganopnictogen compoundspyrroles |
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| Substituents | secondary aliphatic aminearomatic heteromonocyclic compoundazacycleheteroaromatic compoundsecondary aminepyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundamine |
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