| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:59:38 UTC |
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| Update Date | 2025-03-21 18:06:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00061333 |
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| Frequency | 50.8 |
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| Structure | |
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| Chemical Formula | C9H8O3 |
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| Molecular Mass | 164.0473 |
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| SMILES | COc1ccc2c(c1)OCC2=O |
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| InChI Key | BLLMRPOVMOPQKC-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 | benzofurans |
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| Subclass | benzofuranones |
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| Direct Parent | benzofuranones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersanisolesaryl alkyl ketonescoumaranshydrocarbon derivativesorganic oxidesoxacyclic compounds |
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| Substituents | phenol etheretheraryl alkyl ketonebenzofuranonealkyl aryl etherketoneoxacycleorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundanisolehydrocarbon derivativebenzenoidcoumaranorganooxygen compoundaryl ketone |
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