| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 12:21:19 UTC |
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| Update Date | 2025-03-24 21:35:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01828224 |
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| Frequency | 0.7 |
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| Structure | |
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| Chemical Formula | C6H9NO2 |
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| Molecular Mass | 127.0633 |
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| SMILES | CC(=C=C=O)NCCO |
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| InChI Key | AGQTYNWDQUTMRF-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 | alkanolamines |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alcohols and polyolsdialkylamineshydrocarbon derivativesorganic oxidesorganopnictogen compounds |
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| Substituents | alcoholaliphatic acyclic compoundsecondary aliphatic aminesecondary amineorganic oxideorganic oxygen compoundorganopnictogen compoundhydrocarbon derivativeorganooxygen compoundalkanolamine |
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