| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:50:47 UTC |
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| Update Date | 2025-03-25 00:50:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02180321 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H16O4 |
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| Molecular Mass | 272.1049 |
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| SMILES | COc1ccc(-c2coc3c(c2=O)CCC(O)C3)cc1 |
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| InChI Key | MDJCJKZIRHSRFV-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 | phenol ethers |
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| Subclass | anisoles |
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| Direct Parent | anisoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersheteroaromatic compoundshydrocarbon derivativesmethoxybenzenesorganic oxidesoxacyclic compoundsphenoxy compoundspyranones and derivativessecondary alcohols |
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| Substituents | alcoholmonocyclic benzene moietyetherheteroaromatic compoundalkyl aryl ethermethoxybenzeneoxacycleorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundpyrananisolepyranonesecondary alcoholhydrocarbon derivativephenoxy compoundorganoheterocyclic compoundorganooxygen compound |
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