| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:00:48 UTC |
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| Update Date | 2025-03-25 00:53:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02203056 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H16N2O3 |
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| Molecular Mass | 272.1161 |
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| SMILES | O=C(c1ccco1)N1CCN(c2ccccc2O)CC1 |
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| InChI Key | YETIEXCMUFHRMU-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 | diazinanes |
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| Subclass | piperazines |
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| Direct Parent | phenylpiperazines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoids2-heteroaryl carboxamidesamino acids and derivativesaniline and substituted anilinesazacyclic compoundscarboxylic acids and derivativesdialkylarylaminesfuroic acid and derivativesheteroaromatic compoundshydrocarbon derivativesn-arylpiperazinesorganic oxidesorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundstertiary carboxylic acid amideso-aminophenols |
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| Substituents | furanmonocyclic benzene moietyaromatic heteromonocyclic compoundamino acid or derivatives1-hydroxy-2-unsubstituted benzenoidcarboxylic acid derivative2-heteroaryl carboxamideorganic oxidetertiary aliphatic/aromatic aminetertiary carboxylic acid amideorganonitrogen compoundorganopnictogen compounddialkylarylaminetertiary aminefuroic acid or derivativesazacycleaniline or substituted anilinesheteroaromatic compoundaminophenol1-hydroxy-4-unsubstituted benzenoidcarboxamide groupphenylpiperazineoxacycleorganic oxygen compoundphenolhydrocarbon derivativebenzenoidorganic nitrogen compoundo-aminophenolaminen-arylpiperazineorganooxygen compound |
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