| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:47:06 UTC |
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| Update Date | 2025-03-25 00:49:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02171829 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H18N2O2 |
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| Molecular Mass | 270.1368 |
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| SMILES | CN(C)CC(c1ccc2c(c1)OCO2)c1ccccn1 |
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| InChI Key | QVFAZGGUQYKSEQ-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 | 2-halopyridinesacetalsazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesmethylpyridinesorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundstrialkylamines |
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| Substituents | azacycleheteroaromatic compoundtertiary aliphatic aminemethylpyridineoxacyclepyridineorganic oxygen compoundacetalaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoid2-halopyridineorganic nitrogen compoundaminetertiary amineorganooxygen compoundbenzodioxole |
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