| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 10:05:00 UTC |
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| Update Date | 2025-03-24 20:35:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01501576 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C7H8O3 |
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| Molecular Mass | 140.0473 |
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| SMILES | CC1=CCC(C(=O)O)=CO1 |
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| InChI Key | OZEBHDUKOFTNHQ-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 acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsvinylogous esters |
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| Substituents | carbonyl groupcarboxylic acidvinylogous estercarboxylic acid derivativeoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundpyranaliphatic heteromonocyclic compoundhydrocarbon derivativeorganooxygen compound |
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