| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:52:23 UTC |
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| Update Date | 2025-03-25 00:50:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02183888 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H12O3 |
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| Molecular Mass | 216.0786 |
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| SMILES | O=C1CCCC1=Cc1ccc2c(c1)OCO2 |
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| InChI Key | WGPZONFYCCSFLS-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 | acetalsbenzenoidscyclic ketoneshydrocarbon derivativesorganic oxidesoxacyclic compounds |
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| Substituents | carbonyl groupcyclic ketoneketoneoxacycleorganic oxideorganic oxygen compoundacetalaromatic heteropolycyclic compoundhydrocarbon derivativebenzenoidorganooxygen compoundbenzodioxole |
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