| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:15:56 UTC |
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| Update Date | 2025-03-21 18:34:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00100321 |
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| Frequency | 27.3 |
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| Structure | |
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| Chemical Formula | C18H21NO3 |
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| Molecular Mass | 299.1521 |
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| SMILES | COc1ccc2c3c1OC1C(O)C=CC4CCN(C)C(C2)C341 |
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| InChI Key | VPBCKDKTZYCMGI-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 | indanes |
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| Direct Parent | indanes |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersanisolesazacyclic compoundscoumaranshydrocarbon derivativesorganopnictogen compoundsoxacyclic compoundspiperidinessecondary alcoholstrialkylamines |
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| Substituents | alcoholphenol etheretherazacycletertiary aliphatic aminealkyl aryl etheroxacycleorganic oxygen compoundaromatic heteropolycyclic compoundanisoleindaneorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundpiperidineaminetertiary amineorganoheterocyclic compoundcoumaranorganooxygen compound |
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