| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:50:23 UTC |
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| Update Date | 2025-03-21 18:02:40 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00039458 |
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| Frequency | 88.2 |
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| Structure | |
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| Chemical Formula | C14H23NO4 |
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| Molecular Mass | 269.1627 |
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| SMILES | COCCc1ccc(OCC(O)CNCCO)cc1 |
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| InChI Key | VXYZDUCIEAVZEO-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 | tyrosols and derivatives |
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| Direct Parent | tyrosols and derivatives |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alkanolaminesalkyl aryl ethersdialkyl ethersdialkylamineshydrocarbon derivativesorganopnictogen compoundsphenol ethersphenoxy compoundssecondary alcohols |
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| Substituents | alcoholphenol ethersecondary aliphatic aminemonocyclic benzene moietyetheralkyl aryl ethersecondary aminedialkyl etheraromatic homomonocyclic compoundorganic oxygen compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativetyrosol derivativeorganic nitrogen compoundphenoxy compoundorganooxygen compoundaminealkanolamine |
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