| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:37:44 UTC |
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| Update Date | 2025-03-25 00:45:39 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02150519 |
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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 | CCC(O)C1=CC(=O)c2ccccc2C1=O |
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| InChI Key | WAUGQUBIUZPIFO-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 | naphthoquinones |
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| Direct Parent | naphthoquinones |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | aryl ketoneshydrocarbon derivativesorganic oxidesquinonessecondary alcohols |
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| Substituents | alcoholaromatic homopolycyclic compoundketoneorganic oxideorganic oxygen compoundsecondary alcoholhydrocarbon derivativenaphthoquinoneorganooxygen compoundaryl ketonequinone |
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