| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:50:26 UTC |
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| Update Date | 2025-03-25 00:50:13 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02179505 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H17NO3 |
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| Molecular Mass | 271.1208 |
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| SMILES | COc1ccc2c3c1OC1C4(O)C=CC31C(C2)N(C)C4 |
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| InChI Key | SJRWRCPETWNUHJ-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 compoundsazepinescoumaranshydrocarbon derivativesorganopnictogen compoundsoxacyclic compoundspiperidinestertiary alcoholstrialkylamines |
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| Substituents | phenol etheretheralkyl aryl etheraromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundpiperidinetertiary amineorganoheterocyclic compoundcoumaranalcoholazacycletertiary aliphatic amineoxacycletertiary alcoholorganic oxygen compoundazepineanisoleindanehydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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