| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:56:19 UTC |
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| Update Date | 2025-03-21 18:04:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00053479 |
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| Frequency | 60.5 |
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| Structure | |
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| Chemical Formula | C13H12O3 |
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| Molecular Mass | 216.0786 |
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| SMILES | CC1=C(CCC(=O)O)c2ccccc2C1=O |
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| InChI Key | RAISNLXKGYBHHG-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | indenes and isoindenes |
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| Subclass | indenes and isoindenes |
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| Direct Parent | indenes and isoindenes |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | aryl ketonescarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
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| Substituents | carbonyl groupcarboxylic acidaromatic homopolycyclic compoundcarboxylic acid derivativeketoneorganic oxidemonocarboxylic acid or derivativesindeneorganic oxygen compoundhydrocarbon derivativeorganooxygen compoundaryl ketone |
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