| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:22:11 UTC |
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| Update Date | 2025-03-25 01:01:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02252094 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H15N3O2 |
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| Molecular Mass | 209.1164 |
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| SMILES | NCC(=O)CC(N)c1cccc(O)c1N |
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| InChI Key | NXGWKHYUFRHLQQ-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 | phenylbutylamines |
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| Direct Parent | phenylbutylamines |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidshydrocarbon derivativesketonesmonoalkylaminesorganic oxidesorganopnictogen compounds |
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| Substituents | carbonyl group1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidketonearomatic homomonocyclic compoundorganic oxidephenylbutylamineorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundphenolhydrocarbon derivativeprimary aliphatic amineprimary amineorganic nitrogen compoundamineorganooxygen compound |
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