| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:21:34 UTC |
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| Update Date | 2025-03-25 01:01:39 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02250704 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C17H16O3 |
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| Molecular Mass | 268.1099 |
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| SMILES | O=C(O)CC1(O)c2ccccc2CCc2ccccc21 |
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| InChI Key | ZRFVGGWZZUHISL-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 | dibenzocycloheptenes |
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| Subclass | dibenzocycloheptenes |
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| Direct Parent | dibenzocycloheptenes |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidestertiary alcohols |
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| Substituents | alcoholcarbonyl groupcarboxylic acidaromatic homopolycyclic compoundcarboxylic acid derivativedibenzocycloheptenetertiary alcoholorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganooxygen compound |
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