| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:19:09 UTC |
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| Update Date | 2025-03-25 01:00:50 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02245120 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H20N4 |
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| Molecular Mass | 220.1688 |
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| SMILES | CN=C(NC)NCCC(N)c1ccccc1 |
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| InChI Key | OKZIHFYDESWPKK-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 homomonocyclic compounds |
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| Alternative Parents | carboximidamidesguanidineshydrocarbon derivativesiminesmonoalkylaminesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | monocyclic benzene moietyguanidineimineorganic 1,3-dipolar compoundcarboximidamidepropargyl-type 1,3-dipolar organic compoundaromatic homomonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compound |
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