| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:39:29 UTC |
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| Update Date | 2025-03-25 00:46:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02154641 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H18O7 |
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| Molecular Mass | 286.1053 |
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| SMILES | COc1ccc(C2OOC(CO)C(O)C2O)cc1OC |
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| InChI Key | GEPMWIRJRIWPCD-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 | benzene and substituted derivatives |
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| Subclass | methoxybenzenes |
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| Direct Parent | dimethoxybenzenes |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1,2-dioxanesalkyl aryl ethersanisolesdialkyl peroxideshydrocarbon derivativesoxacyclic compoundsphenoxy compoundsprimary alcoholssecondary alcohols |
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| Substituents | alcoholphenol etheretheraromatic heteromonocyclic compoundalkyl aryl etherdimethoxybenzeneoxacycleorganic oxygen compoundanisoleo-dimethoxybenzenedialkyl peroxidesecondary alcoholhydrocarbon derivativephenoxy compoundprimary alcoholortho-dioxaneorganoheterocyclic compoundorganooxygen compound |
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