| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:59:19 UTC |
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| Update Date | 2025-03-25 00:53:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02199708 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H19N3O2 |
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| Molecular Mass | 249.1477 |
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| SMILES | N=C(C(N)Cc1ccc(O)cc1)N1CCC(O)C1 |
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| InChI Key | ISAXWJKYROSZOZ-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 | phenethylamines |
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| Direct Parent | amphetamines and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsamidinesazacyclic compoundsbenzene and substituted derivativescarboximidamideshydrocarbon derivativesmonoalkylaminesorganopnictogen compoundspyrrolidinessecondary alcohols |
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| Substituents | alcoholaromatic heteromonocyclic compoundazacycle1-hydroxy-2-unsubstituted benzenoidamidinecarboximidamideorganic oxygen compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundphenolhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundpyrrolidineorganoheterocyclic compoundorganooxygen compoundamphetamine or derivatives |
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