| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:35:44 UTC |
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| Update Date | 2025-03-21 17:57:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00005527 |
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| Frequency | 965.5 |
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| Structure | |
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| Chemical Formula | C12H10O3 |
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| Molecular Mass | 202.063 |
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| SMILES | O=C(O)COc1cccc2ccccc12 |
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| InChI Key | GHRYSOFWKRRLMI-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 | benzene and substituted derivatives |
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| Subclass | phenoxyacetic acid derivatives |
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| Direct Parent | phenoxyacetic acid derivatives |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | alkyl aryl etherscarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesnaphthalenesorganic oxidesphenol ethers |
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| Substituents | phenol etherphenoxyacetatecarbonyl groupethercarboxylic acidaromatic homopolycyclic compoundalkyl aryl ethercarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesnaphthaleneorganic oxygen compoundhydrocarbon derivativeorganooxygen compound |
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