Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:39:11 UTC |
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Update Date | 2025-03-25 00:46:12 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02153954 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C21H27NO5 |
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Molecular Mass | 373.1889 |
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SMILES | COc1ccc2c3c1OC1C(C(O)CO)C(O)C=CC2C2CC31CCN2C |
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InChI Key | QTFPGTOEVPMRQM-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 | tetralins |
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Subclass | tetralins |
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Direct Parent | tetralins |
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Geometric Descriptor | aromatic heteropolycyclic compounds |
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Alternative Parents | alkyl aryl ethersanisolesazacyclic compoundscoumaranshydrocarbon derivativesorganopnictogen compoundsoxacyclic compoundspiperidinesprimary alcoholssecondary alcoholstrialkylamines |
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Substituents | tetralinphenol etheretheralkyl aryl etheraromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundprimary alcoholpiperidinetertiary amineorganoheterocyclic compoundcoumaranalcoholazacycletertiary aliphatic amineoxacycleorganic oxygen compoundanisolesecondary alcoholhydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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