| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:18 UTC |
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| Update Date | 2025-03-25 00:46:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02158660 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H14O3 |
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| Molecular Mass | 218.0943 |
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| SMILES | OC1c2cc3c(cc2C2CCC1C2)OCO3 |
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| InChI Key | IBKCFCGHUZNAEH-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 | acetalsbenzodioxoleshydrocarbon derivativesoxacyclic compoundssecondary alcohols |
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| Substituents | alcoholtetralinoxacycleorganic oxygen compoundacetalaromatic heteropolycyclic compoundsecondary alcoholhydrocarbon derivativeorganoheterocyclic compoundorganooxygen compoundbenzodioxole |
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