| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:17:57 UTC |
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| Update Date | 2025-03-25 01:00:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02242280 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H22N2O |
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| Molecular Mass | 234.1732 |
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| SMILES | CC(C)NCC(O)CN1Cc2ccccc2C1 |
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| InChI Key | OIXLZBAIWWAXNI-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | isoindoles and derivatives |
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| Subclass | isoindoles |
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| Direct Parent | isoindoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1,2-aminoalcoholsaralkylaminesazacyclic compoundsbenzenoidsdialkylamineshydrocarbon derivativesisoindolinesorganopnictogen compoundssecondary alcoholstrialkylamines |
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| Substituents | alcoholsecondary aliphatic amineazacycle1,2-aminoalcoholisoindoletertiary aliphatic aminesecondary aminearalkylamineorganic oxygen compoundisoindolinearomatic heteropolycyclic compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundaminetertiary amineorganooxygen compound |
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