| 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 | DMID02200873 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H19N2O2+ |
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| Molecular Mass | 247.1441 |
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| SMILES | COc1ccc2[nH]cc(C(=O)C[N+](C)(C)C)c2c1 |
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| InChI Key | OCVMEXONXOAGJB-UHFFFAOYSA-O |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | alkaloids and derivatives |
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| Class | Not Available |
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| Subclass | alkaloids and derivatives |
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| Direct Parent | alkaloids and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersalpha-amino ketonesaminesanisolesaryl alkyl ketonesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesindolesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundspyrrolestetraalkylammonium saltsvinylogous amides |
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| Substituents | phenol etheretheraryl alkyl ketoneindolealkyl aryl etherketoneorganic oxidealpha-aminoketonearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundorganic cationorganic saltorganoheterocyclic compoundvinylogous amidetetraalkylammonium saltazacyclequaternary ammonium saltheteroaromatic compoundindole or derivativesalkaloid or derivativesorganic oxygen compoundanisolepyrrolehydrocarbon derivativebenzenoidorganic nitrogen compoundamineorganooxygen compoundaryl ketone |
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