| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:49:34 UTC |
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| Update Date | 2025-03-25 00:49:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02177557 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H20O10 |
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| Molecular Mass | 360.1056 |
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| SMILES | COc1cc(C(O)C=O)ccc1OC1OC(C(O)O)C(O)C(O)C1O |
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| InChI Key | XEVOLKWLDWDZPF-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 | benzene and substituted derivatives |
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| Subclass | phenylacetaldehydes |
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| Direct Parent | phenylacetaldehydes |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | acetalsalkyl aryl ethersalpha-hydroxyaldehydesanisolesaromatic alcoholscarbonyl hydrateshydrocarbon derivativesmethoxybenzenesmonosaccharidesorganic oxidesoxacyclic compoundsoxanesphenoxy compoundssecondary alcohols |
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| Substituents | aromatic alcoholphenol ethercarbonyl groupethercarbonyl hydratearomatic heteromonocyclic compoundmonosaccharidealkyl aryl ethersaccharideorganic oxidealpha-hydroxyaldehydeacetaloxaneorganoheterocyclic compoundalcoholaldehydemethoxybenzeneoxacycleorganic oxygen compoundanisolesecondary alcoholhydrocarbon derivativephenoxy compoundorganooxygen compoundphenylacetaldehyde |
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