Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:40:31 UTC |
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Update Date | 2025-03-25 00:46:43 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02156951 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C14H14O4 |
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Molecular Mass | 246.0892 |
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SMILES | O=C1C=CCC2C1COC2c1ccc(O)c(O)c1 |
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InChI Key | FWAYNAOUIZOPFU-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 | phenols |
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Subclass | 1-hydroxy-2-unsubstituted benzenoids |
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Direct Parent | 1-hydroxy-2-unsubstituted benzenoids |
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Geometric Descriptor | aromatic heteropolycyclic compounds |
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Alternative Parents | 1-hydroxy-4-unsubstituted benzenoidsbenzene and substituted derivativescyclohexenonesdialkyl ethershydrocarbon derivativesketonesorganic oxidesoxacyclic compoundstetrahydrofurans |
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Substituents | cyclohexenonemonocyclic benzene moietycarbonyl groupethertetrahydrofuran1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoiddialkyl etherketoneoxacycleorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundhydrocarbon derivativeorganoheterocyclic compoundorganooxygen compound |
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