| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:53:44 UTC |
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| Update Date | 2025-03-21 18:03:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00047535 |
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| Frequency | 70.0 |
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| Structure | |
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| Chemical Formula | C15H16O3 |
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| Molecular Mass | 244.1099 |
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| SMILES | COc1ccc2cc(C(C)(C)C(=O)O)ccc2c1 |
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| InChI Key | IYSPYQQBEYOGFI-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 | naphthalenes |
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| Subclass | naphthalenes |
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| Direct Parent | naphthalenes |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersanisolescarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
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| Substituents | phenol ethercarbonyl groupethercarboxylic acidaromatic homopolycyclic compoundalkyl aryl ethercarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesnaphthaleneorganic oxygen compoundanisolehydrocarbon derivativeorganooxygen compound |
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