| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:05:09 UTC |
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| Update Date | 2025-03-25 00:55:37 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02213313 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H19N3 |
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| Molecular Mass | 205.1579 |
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| SMILES | CN1CCCN(Cc2cccnc2)CC1 |
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| InChI Key | MLCGZBGCZPUQAU-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 | diazepanes |
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| Subclass | 1,4-diazepanes |
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| Direct Parent | 1,4-diazepanes |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | aralkylaminesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesmethylpyridinesorganopnictogen compoundstrialkylamines |
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| Substituents | 1,4-diazepanearomatic heteromonocyclic compoundazacycleheteroaromatic compoundtertiary aliphatic aminemethylpyridinearalkylaminepyridineorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundaminetertiary amine |
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