| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:07:06 UTC |
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| Update Date | 2025-03-25 00:56:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02217750 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H13NO5 |
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| Molecular Mass | 227.0794 |
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| SMILES | O=Cc1c[nH]cc1C1OC(CO)C(O)C1O |
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| InChI Key | WVXQFUOFPGSLSE-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | aryl-aldehydes |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsdialkyl ethersheteroaromatic compoundshydrocarbon derivativesmonosaccharidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsprimary alcoholspyrrolessecondary alcoholstetrahydrofuransvinylogous amides |
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| Substituents | etheraromatic heteromonocyclic compoundmonosaccharidedialkyl ethersaccharideorganic oxidearyl-aldehydeorganonitrogen compoundorganopnictogen compoundprimary alcoholorganoheterocyclic compoundalcoholvinylogous amideazacycletetrahydrofuranheteroaromatic compoundoxacyclepyrrolesecondary alcoholhydrocarbon derivativeorganic nitrogen compound |
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