| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:06:43 UTC |
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| Update Date | 2025-03-25 00:56:12 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02216840 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C17H25NO11 |
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| Molecular Mass | 419.1428 |
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| SMILES | O=C(CCC(O)Cc1ccc(O)c(O)c1)ONC1OC(C(O)O)C(O)C(O)C1O |
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| InChI Key | LSJFBDPCHRYAKX-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 | phenols |
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| Subclass | 1-hydroxy-2-unsubstituted benzenoids |
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| Direct Parent | 1-hydroxy-2-unsubstituted benzenoids |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1-hydroxy-4-unsubstituted benzenoidsbenzene and substituted derivativescarbonyl compoundscarbonyl hydratescarboxylic acid saltshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesorganic saltsorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanessecondary alcohols |
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| Substituents | monocyclic benzene moietycarbonyl groupcarbonyl hydratearomatic heteromonocyclic compound1-hydroxy-2-unsubstituted benzenoidmonosaccharidecarboxylic acid derivativesaccharideorganic oxideorganonitrogen compoundorganopnictogen compoundoxaneorganic saltorganoheterocyclic compoundalcohol1-hydroxy-4-unsubstituted benzenoidoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganic nitrogen compoundcarboxylic acid saltorganooxygen compound |
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