| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:48:38 UTC |
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| Update Date | 2025-03-25 00:49:35 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02175357 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C20H19NO3 |
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| Molecular Mass | 321.1365 |
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| SMILES | COc1ccc(C2CC(=O)CC(c3c[nH]c4ccccc34)O2)cc1 |
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| InChI Key | CXNBDUKQZNQZRD-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 | indoles and derivatives |
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| Subclass | indoles |
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| Direct Parent | indoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersanisolesazacyclic compoundscyclic ketonesdialkyl ethersheteroaromatic compoundshydrocarbon derivativesmethoxybenzenesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanesphenoxy compoundspyrroles |
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| Substituents | phenol ethermonocyclic benzene moietycarbonyl groupetherindolecyclic ketonealkyl aryl etherdialkyl etherketoneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundoxaneazacycleheteroaromatic compoundmethoxybenzeneoxacycleorganic oxygen compoundanisolepyrrolehydrocarbon derivativebenzenoidorganic nitrogen compoundphenoxy compoundorganooxygen compound |
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