| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:02:40 UTC |
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| Update Date | 2025-03-25 00:54:35 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02207341 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H17NO8 |
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| Molecular Mass | 315.0954 |
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| SMILES | Nc1ccc(OC2OC(C(=O)O)C(O)C(O)C(O)C2O)cc1 |
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| InChI Key | ZFECAXZSOULNSG-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 | phenol ethers |
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| Subclass | phenol ethers |
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| Direct Parent | phenol ethers |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | acetalsamino acidsbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundsoxacyclic compoundsoxepanesphenoxy compoundsprimary aminessecondary alcohols |
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| Substituents | phenol ethermonocyclic benzene moietycarbonyl groupcarboxylic acidaromatic heteromonocyclic compoundamino acid or derivativesamino acidcarboxylic acid derivativebeta-hydroxy acidorganic oxideacetalorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundalcoholhydroxy acidoxepaneoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeprimary amineorganic nitrogen compoundphenoxy compoundamineorganooxygen compound |
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