| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:53:51 UTC |
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| Update Date | 2025-03-25 00:51:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02187308 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H16O4 |
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| Molecular Mass | 272.1049 |
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| SMILES | CC(=O)c1cc2c(cc1C)C(=O)C(C)=C2CCC(=O)O |
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| InChI Key | HHGAHTIICIJPCS-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 | indenes and isoindenes |
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| Subclass | indenes and isoindenes |
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| Direct Parent | indenes and isoindenes |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | acetophenonesaryl alkyl ketonescarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
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| Substituents | carbonyl groupcarboxylic acidaryl alkyl ketonearomatic homopolycyclic compoundcarboxylic acid derivativeketoneorganic oxidemonocarboxylic acid or derivativesindeneorganic oxygen compoundacetophenonehydrocarbon derivativeorganooxygen compoundaryl ketone |
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