| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:59:39 UTC |
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| Update Date | 2025-03-25 00:53:34 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02200471 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C19H20O6 |
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| Molecular Mass | 344.126 |
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| SMILES | COc1ccc(C2c3cc4c(cc3CC(C)(O)C2O)OCO4)cc1O |
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| InChI Key | SQMLGRPBZWHNNR-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 | tetralins |
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| Subclass | tetralins |
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| Direct Parent | tetralins |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1,2-diols1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsacetalsalkyl aryl ethersanisolesbenzodioxoleshydrocarbon derivativesmethoxybenzenesmethoxyphenolsoxacyclic compoundsphenoxy compoundssecondary alcoholstertiary alcohols |
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| Substituents | tetralinphenol ethermonocyclic benzene moietyether1-hydroxy-2-unsubstituted benzenoidmethoxyphenolalkyl aryl etheracetalaromatic heteropolycyclic compoundorganoheterocyclic compoundbenzodioxole1,2-diolalcohol1-hydroxy-4-unsubstituted benzenoidmethoxybenzeneoxacycletertiary alcoholorganic oxygen compoundanisolesecondary alcoholphenolhydrocarbon derivativephenoxy compoundorganooxygen compound |
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