| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:07:53 UTC |
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| Update Date | 2025-03-21 18:30:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00081140 |
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| Frequency | 35.7 |
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| Structure | |
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| Chemical Formula | C14H16O2 |
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| Molecular Mass | 216.115 |
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| SMILES | CC1=C(CCC(=O)O)CCc2ccccc21 |
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| InChI Key | HJPQFFBQZOIJDU-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 | carbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
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| Substituents | carbonyl grouporganic oxidemonocarboxylic acid or derivativesnaphthalenecarboxylic acidorganic oxygen compoundaromatic homopolycyclic compoundhydrocarbon derivativecarboxylic acid derivativeorganooxygen compound |
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