| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:54:48 UTC |
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| Update Date | 2025-03-25 00:51:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02189480 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C20H25NO3 |
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| Molecular Mass | 327.1834 |
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| SMILES | CC(CCCN1CCc2cc(O)c(O)cc2C1)c1ccc(O)cc1 |
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| InChI Key | DTHDDSFLKYEMJN-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 | benzene and substituted derivatives |
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| Subclass | phenylbutylamines |
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| Direct Parent | phenylbutylamines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsaralkylaminesazacyclic compoundshydrocarbon derivativesorganooxygen compoundsorganopnictogen compoundstetrahydroisoquinolinestrialkylamines |
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| Substituents | azacycletertiary aliphatic amine1-hydroxy-2-unsubstituted benzenoidaralkylaminephenylbutylamineorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundtetrahydroisoquinolineorganopnictogen compoundphenolhydrocarbon derivativeorganic nitrogen compoundaminetertiary amineorganoheterocyclic compoundorganooxygen compound |
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