Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:50:25 UTC |
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Update Date | 2025-03-25 00:50:12 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02179459 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C16H21NO |
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Molecular Mass | 243.1623 |
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SMILES | COc1ccc2c(c1)C13CCC(C2)N(CC1)CC3 |
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InChI Key | FAOCXRKHEIQKEC-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 | benzazocines |
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Direct Parent | benzazocines |
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Geometric Descriptor | aromatic heteropolycyclic compounds |
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Alternative Parents | alkyl aryl ethersanisolesazacyclic compoundsazepaneshydrocarbon derivativesorganopnictogen compoundspiperidinestrialkylamines |
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Substituents | phenol etheretherazacycletertiary aliphatic aminealkyl aryl etherazepaneorganic oxygen compoundaromatic heteropolycyclic compoundanisolebenzazocineorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundpiperidineaminetertiary amineorganoheterocyclic compoundorganooxygen compound |
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