| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:07:52 UTC |
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| Update Date | 2025-03-25 00:56:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02219541 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H10O4 |
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| Molecular Mass | 218.0579 |
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| SMILES | COc1ccc(C(=O)c2occc2O)cc1 |
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| InChI Key | PBWNDVCYTVJVTC-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | aryl-phenylketones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alkyl aryl ethersanisolesaryl ketonesbenzoyl derivativesfuroic acid and derivativesheteroaromatic compoundshydrocarbon derivativesmethoxybenzenesorganic oxidesoxacyclic compoundsphenoxy compoundsvinylogous acids |
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| Substituents | furanphenol ethermonocyclic benzene moietyetherfuroic acid or derivativesaromatic heteromonocyclic compoundaryl-phenylketoneheteroaromatic compoundbenzoylalkyl aryl ethermethoxybenzeneoxacyclevinylogous acidorganic oxideanisolehydrocarbon derivativebenzenoidphenoxy compoundorganoheterocyclic compound |
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