| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:03:49 UTC |
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| Update Date | 2025-03-21 18:28:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00071296 |
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| Frequency | 42.1 |
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| Structure | |
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| Chemical Formula | C12H17NO5 |
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| Molecular Mass | 255.1107 |
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| SMILES | OCC1OC(Nc2ccccc2)C(O)C(O)C1O |
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| InChI Key | LKZGXPMJCWRGTC-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic nitrogen compounds |
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| Class | organonitrogen compounds |
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| Subclass | amines |
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| Direct Parent | phenylalkylamines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | benzene and substituted derivativeshydrocarbon derivativesmonosaccharidesorganopnictogen compoundsoxacyclic compoundsoxanesprimary alcoholssecondary alcoholssecondary alkylarylamines |
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| Substituents | alcoholmonocyclic benzene moietyaromatic heteromonocyclic compoundmonosaccharidesecondary aminesecondary aliphatic/aromatic amineoxacyclesaccharideorganic oxygen compoundsecondary alcoholorganopnictogen compoundphenylalkylaminehydrocarbon derivativebenzenoidoxaneprimary alcoholorganoheterocyclic compoundorganooxygen compound |
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