| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:21:52 UTC |
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| Update Date | 2025-03-25 01:01:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02251398 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C20H23Br2NO |
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| Molecular Mass | 451.0146 |
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| SMILES | Brc1ccc(C(CCCN2CCOCC2)c2ccc(Br)cc2)cc1 |
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| InChI Key | NACQILOHDUKTNK-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 | diphenylmethanes |
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| Direct Parent | diphenylmethanes |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | aryl bromidesazacyclic compoundsbromobenzenesdialkyl ethershydrocarbon derivativesmorpholinesorganobromidesorganopnictogen compoundsoxacyclic compoundsphenylbutylaminestrialkylamines |
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| Substituents | diphenylmethaneetheraromatic heteromonocyclic compoundorganohalogen compounddialkyl etherphenylbutylamineorganonitrogen compoundorganopnictogen compoundtertiary amineorganoheterocyclic compoundazacycletertiary aliphatic aminebromobenzeneoxazinanearyl halideoxacyclemorpholineorganic oxygen compoundorganobromidehydrocarbon derivativeorganic nitrogen compoundhalobenzenearyl bromideamineorganooxygen compound |
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