| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:52:55 UTC |
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| Update Date | 2025-03-25 00:51:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02185104 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H13N3O |
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| Molecular Mass | 143.1059 |
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| SMILES | NC(=O)N1CCCNCC1 |
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| InChI Key | QDYWEAYMBBJBPO-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 | aliphatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundsdialkylamineshydrocarbon derivativesorganic carbonic acids and derivativesorganic oxidesorganopnictogen compounds |
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| Substituents | secondary aliphatic aminecarbonyl groupcarbonic acid derivative1,4-diazepaneazacyclesecondary amineorganic oxideorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
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