| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:27:38 UTC |
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| Update Date | 2025-03-21 18:40:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00128569 |
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| Frequency | 19.8 |
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| Structure | |
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| Chemical Formula | C12H8O4 |
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| Molecular Mass | 216.0423 |
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| SMILES | CC1=CC(=O)c2cc(C(=O)O)ccc2C1=O |
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| InChI Key | PNFFSXQYFYEYME-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 | naphthalenecarboxylic acids and derivatives |
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| Direct Parent | naphthalenecarboxylic acids |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | aryl ketonescarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesnaphthoquinonesorganic oxidesorganooxygen compoundsquinones |
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| Substituents | carboxylic acidaromatic homopolycyclic compoundcarboxylic acid derivativeketoneorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivative2-naphthalenecarboxylic acidnaphthoquinoneorganooxygen compoundaryl ketonequinone |
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