| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:50:49 UTC |
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| Update Date | 2025-03-25 00:50:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02180377 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H12O5 |
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| Molecular Mass | 248.0685 |
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| SMILES | COc1ccc(-c2occ(CO)c(=O)c2O)cc1 |
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| InChI Key | NZTXLKWHLKYXNF-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 heteromonocyclic compounds |
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| Alternative Parents | alkyl aryl ethersaromatic alcoholscyclic ketonesheteroaromatic compoundshydrocarbon derivativesmethoxybenzenesorganic oxidesoxacyclic compoundsphenoxy compoundspyranones and derivatives |
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| Substituents | aromatic alcoholalcoholmonocyclic benzene moietyetheraromatic heteromonocyclic compoundheteroaromatic compoundcyclic ketonealkyl aryl ethermethoxybenzeneoxacycleorganic oxideorganic oxygen compoundpyrananisolepyranonehydrocarbon derivativephenoxy compoundorganoheterocyclic compoundorganooxygen compound |
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