| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:20:46 UTC |
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| Update Date | 2025-03-25 01:01:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02248862 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H12O3 |
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| Molecular Mass | 216.0786 |
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| SMILES | COc1cc2c(c3ccccc13)OCCO2 |
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| InChI Key | DUGLHMWIFIGSCM-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 | naphthalenes |
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| Subclass | naphthalenes |
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| Direct Parent | naphthalenes |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersanisolesbenzo-1,4-dioxaneshydrocarbon derivativesoxacyclic compoundspara dioxins |
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| Substituents | benzo-1,4-dioxanephenol etheretheralkyl aryl etherbenzodioxaneoxacyclenaphthaleneorganic oxygen compoundpara-dioxinaromatic heteropolycyclic compoundanisolehydrocarbon derivativeorganoheterocyclic compoundorganooxygen compound |
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