| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 05:07:47 UTC |
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| Update Date | 2025-03-24 14:12:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00789222 |
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| Frequency | 1.9 |
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| Structure | |
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| Chemical Formula | C5H7N3 |
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| Molecular Mass | 109.064 |
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| SMILES | CN(CC#N)CC#N |
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| InChI Key | ODHFXNCHFIWUCX-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic nitrogen compounds |
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| Class | organonitrogen compounds |
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| Subclass | amines |
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| Direct Parent | trialkylamines |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha-aminonitrileshydrocarbon derivativesorganopnictogen compounds |
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| Substituents | aliphatic acyclic compoundnitriletertiary aliphatic amineorganopnictogen compoundhydrocarbon derivativealpha-aminonitrilecarbonitrile |
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