| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 01:52:24 UTC |
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| Update Date | 2025-03-21 20:06:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00325177 |
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| Frequency | 6.0 |
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| Structure | |
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| Chemical Formula | C7H9NO2 |
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| Molecular Mass | 139.0633 |
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| SMILES | CC1=CCC(C(N)=O)=CO1 |
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| InChI Key | MICRJAIEJHIJOH-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 | pyrans |
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| Subclass | pyrans |
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| Direct Parent | pyrans |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsprimary carboxylic acid amidesvinylogous esters |
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| Substituents | primary carboxylic acid amidecarbonyl groupvinylogous estercarboxamide groupcarboxylic acid derivativeoxacycleorganic oxideorganic oxygen compoundpyranaliphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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