| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:22:46 UTC |
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| Update Date | 2025-03-21 18:37:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00117076 |
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| Frequency | 22.4 |
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| Structure | |
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| Chemical Formula | C21H18O5 |
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| Molecular Mass | 350.1154 |
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| SMILES | OC1COC(Oc2ccc3ccc4cccc5ccc2c3c45)C(O)C1O |
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| InChI Key | AFAJMNBEYVGGLB-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 | acetalshydrocarbon derivativesmonosaccharidesnaphthalenesoxacyclic compoundsoxanesphenanthrenes and derivativesphenol etherssecondary alcohols |
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| Substituents | alcoholphenol etherphenanthrenemonosaccharideoxacyclepyrenesaccharidenaphthaleneorganic oxygen compoundacetalaromatic heteropolycyclic compoundsecondary alcoholhydrocarbon derivativeoxaneorganoheterocyclic compoundorganooxygen compound |
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