| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:59:45 UTC |
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| Update Date | 2025-03-25 00:53:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02200711 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H14O3 |
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| Molecular Mass | 230.0943 |
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| SMILES | COc1ccc2cc(C(C=O)CO)ccc2c1 |
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| InChI Key | CJORATIQWNAISY-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 | aldehydesalkyl aryl ethersanisoleshydrocarbon derivativesorganic oxidesphenylacetaldehydesprimary alcohols |
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| Substituents | alcoholphenol ethercarbonyl groupetheraldehydearomatic homopolycyclic compoundalkyl aryl etherorganic oxidenaphthaleneorganic oxygen compoundanisolehydrocarbon derivativeprimary alcoholorganooxygen compoundphenylacetaldehyde |
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