| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:38:11 UTC |
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| Update Date | 2025-03-25 00:45:50 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02151547 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C23H20Cl2N4O2 |
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| Molecular Mass | 454.0963 |
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| SMILES | Clc1ccc(C2(Cn3ccnc3)COC(Cn3ccnc3)(c3ccc(Cl)cc3)O2)cc1 |
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| InChI Key | COVZNXGOIGFFDH-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | halobenzenes |
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| Direct Parent | chlorobenzenes |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1,3-dioxolanesaryl chloridesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesketalsn-substituted imidazolesorganochloridesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsoxacyclic compounds |
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| Substituents | meta-dioxolanearomatic heteromonocyclic compoundorganochlorideorganohalogen compoundacetalimidazoleketalorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundazolen-substituted imidazolearyl chloridechlorobenzeneazacycleheteroaromatic compoundaryl halideoxacycleorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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