| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:19:28 UTC |
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| Update Date | 2025-03-21 18:36:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00109046 |
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| Frequency | 24.5 |
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| Structure | |
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| Chemical Formula | C7H12N2O |
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| Molecular Mass | 140.095 |
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| SMILES | CNCC(O)c1ccc[nH]1 |
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| InChI Key | GDNABVJEZIHDTC-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 | aromatic alcoholsazacyclic compoundsdialkylamineshydrocarbon derivativesorganopnictogen compoundspyrrolessecondary alcohols |
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| Substituents | aromatic alcoholalcoholsecondary aliphatic aminearomatic heteromonocyclic compoundazacycleheteroaromatic compoundsecondary amineorganic oxygen compoundpyrroleorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
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