| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:55:30 UTC |
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| Update Date | 2025-03-21 18:04:35 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00051628 |
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| Frequency | 63.2 |
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| Structure | |
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| Chemical Formula | C17H19NO |
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| Molecular Mass | 253.1467 |
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| SMILES | NCCCC1(c2ccccc2)OCc2ccccc21 |
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| InChI Key | SFGQDYKDYQAIEY-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 | dialkyl ethershydrocarbon derivativesisocoumaransmonoalkylaminesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compounds |
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| Substituents | etherdialkyl etheroxacyclephenylbutylamineisocoumaranorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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