| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:47:05 UTC |
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| Update Date | 2025-03-25 00:49:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02171781 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H17NO2 |
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| Molecular Mass | 219.1259 |
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| SMILES | CN(C)CCC1(O)CC(=O)c2ccccc21 |
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| InChI Key | OZWCYEXFDWVROC-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 | indanes |
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| Subclass | indanones |
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| Direct Parent | indanones |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | 1,3-aminoalcoholsaryl alkyl ketoneshydrocarbon derivativesorganic oxidesorganopnictogen compoundstertiary alcoholstrialkylamines |
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| Substituents | alcoholaryl alkyl ketone1,3-aminoalcoholtertiary aliphatic amineindanonearomatic homopolycyclic compoundketonetertiary alcoholorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundaminetertiary amineorganooxygen compoundaryl ketone |
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