| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:08:56 UTC |
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| Update Date | 2025-03-25 00:56:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02222014 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H14O3 |
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| Molecular Mass | 254.0943 |
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| SMILES | Oc1ccc2c(c1)CCCc1cc3c(cc1-2)OCO3 |
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| InChI Key | JKDDEMMVYDAHHR-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | benzodioxoles |
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| Subclass | benzodioxoles |
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| Direct Parent | benzodioxoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsacetalsbenzenoidshydrocarbon derivativesorganooxygen compoundsoxacyclic compounds |
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| Substituents | oxacycleorganic oxygen compoundacetalaromatic heteropolycyclic compound1-hydroxy-2-unsubstituted benzenoidhydrocarbon derivativebenzenoidorganooxygen compoundbenzodioxole |
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