| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:01:31 UTC |
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| Update Date | 2025-03-21 18:06:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00065781 |
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| Frequency | 46.5 |
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| Structure | |
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| Chemical Formula | C9H11NO3 |
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| Molecular Mass | 181.0739 |
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| SMILES | Oc1cc2c(cc1O)C(O)NCC2 |
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| InChI Key | BKQUGYUAHRJBEL-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 | tetrahydroisoquinolines |
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| Subclass | tetrahydroisoquinolines |
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| Direct Parent | tetrahydroisoquinolines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalkanolaminesazacyclic compoundsbenzenoidsdialkylamineshydrocarbon derivativesorganooxygen compoundsorganopnictogen compounds |
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| Substituents | secondary aliphatic amineazacycle1-hydroxy-2-unsubstituted benzenoidsecondary amineorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundtetrahydroisoquinolineorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compoundaminealkanolamine |
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