| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:58:34 UTC |
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| Update Date | 2025-03-25 00:53:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02197920 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C21H23NO6 |
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| Molecular Mass | 385.1525 |
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| SMILES | COc1cc(C2c3ccccc3NC(O)C3COC(=O)C23)cc(OC)c1OC |
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| InChI Key | IHZPLQXZJIJBCM-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 | benzazepines |
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| Subclass | benzazepines |
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| Direct Parent | benzazepines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkanolaminesalkyl aryl ethersamino acids and derivativesanisolesazacyclic compoundsazepinescarbonyl compoundscarboxylic acid estersgamma butyrolactoneshydrocarbon derivativesmethoxybenzenesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundsoxacyclic compoundsphenoxy compoundssecondary alkylarylaminestetrahydrofurans |
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| Substituents | phenol ethermonocyclic benzene moietycarbonyl groupetheramino acid or derivativesalkyl aryl ethercarboxylic acid derivativelactoneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundalkanolamineazacycletetrahydrofuransecondary aminemethoxybenzenegamma butyrolactonesecondary aliphatic/aromatic amineoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundazepineanisolecarboxylic acid esterhydrocarbon derivativebenzenoidorganic nitrogen compoundphenoxy compoundbenzazepineorganooxygen compoundamine |
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