| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:41:56 UTC |
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| Update Date | 2025-03-21 17:59:14 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00019617 |
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| Frequency | 208.1 |
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| Structure | |
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| Chemical Formula | C20H16O5 |
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| Molecular Mass | 336.0998 |
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| SMILES | OC1OC(Oc2ccc3ccc4cccc5ccc2c3c45)C(O)C1O |
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| InChI Key | MGILDOTUIPEPJK-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 | pyrenes |
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| Subclass | pyrenes |
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| Direct Parent | pyrenes |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1,2-diolsacetalshemiacetalshydrocarbon derivativesmonosaccharidesnaphthalenesoxacyclic compoundsphenanthrenes and derivativesphenol etherssecondary alcoholstetrahydrofurans |
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| Substituents | alcoholphenol etherphenanthrenetetrahydrofuranmonosaccharideoxacyclepyrenesaccharidenaphthaleneorganic oxygen compoundacetalaromatic heteropolycyclic compoundsecondary alcoholhemiacetalhydrocarbon derivativeorganoheterocyclic compoundorganooxygen compound1,2-diol |
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