| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:05:09 UTC |
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| Update Date | 2025-03-25 00:55:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02213302 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H19NO2 |
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| Molecular Mass | 221.1416 |
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| SMILES | CN1CCCC1CC(O)c1cccc(O)c1 |
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| InChI Key | CXZNDVGVXGQJKR-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 | phenols |
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| Subclass | 1-hydroxy-2-unsubstituted benzenoids |
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| Direct Parent | 1-hydroxy-2-unsubstituted benzenoids |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1,3-aminoalcohols1-hydroxy-4-unsubstituted benzenoidsaromatic alcoholsazacyclic compoundsbenzene and substituted derivativeshydrocarbon derivativesn-alkylpyrrolidinesorganopnictogen compoundssecondary alcoholstrialkylamines |
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| Substituents | aromatic alcoholalcoholmonocyclic benzene moiety1,3-aminoalcoholaromatic heteromonocyclic compoundazacyclen-alkylpyrrolidinetertiary aliphatic amine1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidorganic oxygen compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundpyrrolidineaminetertiary amineorganoheterocyclic compoundorganooxygen compound |
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