Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 08:01:56 UTC |
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Update Date | 2025-03-24 22:28:16 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID01207452 |
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Frequency | 1.1 |
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Structure | |
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Chemical Formula | C7H13NO |
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Molecular Mass | 127.0997 |
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SMILES | CCCNC=CC(C)=O |
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InChI Key | PGXCOTMQKOPYOF-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organic oxygen compounds |
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Class | organooxygen compounds |
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Subclass | acryloyl compounds |
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Direct Parent | acryloyl compounds |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | dialkylaminesenoneshydrocarbon derivativesketonesorganic oxidesorganopnictogen compoundsvinylogous amides |
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Substituents | vinylogous amidealiphatic acyclic compoundsecondary aliphatic aminecarbonyl groupsecondary aminealpha,beta-unsaturated ketoneketoneorganic oxideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeacryloyl-grouporganic nitrogen compoundamineenone |
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