| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 04:43:49 UTC |
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| Update Date | 2025-03-24 14:01:49 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00731746 |
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| Frequency | 2.1 |
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| Structure | |
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| Chemical Formula | C7H8O2 |
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| Molecular Mass | 124.0524 |
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| SMILES | CC(=O)C1=COC=CC1 |
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| InChI Key | YRZBMFPKFWEQOI-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 | hydrocarbon derivativesketonesorganic oxidesoxacyclic compoundsvinylogous esters |
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| Substituents | ketoneoxacyclecarbonyl grouporganic oxideorganic oxygen compoundvinylogous esterpyranaliphatic heteromonocyclic compoundhydrocarbon derivativeorganooxygen compound |
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