| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:59:49 UTC |
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| Update Date | 2025-03-25 00:53:37 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02200865 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C17H22N2O |
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| Molecular Mass | 270.1732 |
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| SMILES | COc1ccc2[nH]c3c(c2c1)CCN1CCCCC1C3 |
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| InChI Key | AYYMIMRUQAAUQN-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 | pyrroloazepines |
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| Subclass | pyrroloazepines |
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| Direct Parent | pyrroloazepines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersanisolesazacyclic compoundsazepinesheteroaromatic compoundshydrocarbon derivativesindolesorganopnictogen compoundspiperidinespyrrolestrialkylamines |
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| Substituents | phenol etheretherindolealkyl aryl etheraromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundpiperidinetertiary aminepyrroloazepineazacycleheteroaromatic compoundtertiary aliphatic amineindole or derivativesorganic oxygen compoundazepineanisolepyrrolehydrocarbon derivativebenzenoidorganic nitrogen compoundamineorganooxygen compound |
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