| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:59:55 UTC |
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| Update Date | 2025-03-25 00:53:40 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02201086 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C21H19NO7 |
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| Molecular Mass | 397.1162 |
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| SMILES | COc1cc(C2c3cc4c(cc3C3C(=O)NC(=O)C32)OCO4)cc(OC)c1OC |
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| InChI Key | XKJZRTGFYIXFDN-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 | benzodioxoles |
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| Subclass | benzodioxoles |
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| Direct Parent | benzodioxoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | acetalsalkyl aryl ethersanisolesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesdicarboximideshydrocarbon derivativesindanesmethoxybenzenesn-unsubstituted carboxylic acid imidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsphenoxy compoundspyrrolidine-2-ones |
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| Substituents | 2-pyrrolidonephenol ethermonocyclic benzene moietycarbonyl groupetheralkyl aryl ethercarboxylic acid derivativecarboxylic acid imide, n-unsubstitutedorganic oxideacetalaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compounddicarboximidepyrrolidinepyrrolidonebenzodioxoleazacyclemethoxybenzenecarboxylic acid imideoxacycleorganic oxygen compoundanisoleindanehydrocarbon derivativebenzenoidorganic nitrogen compoundphenoxy compoundorganooxygen compound |
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