| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:41:07 UTC |
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| Update Date | 2025-03-25 01:08:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02295134 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H9NO2 |
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| Molecular Mass | 127.0633 |
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| SMILES | CNC(O)c1ccco1 |
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| InChI Key | XQVQXFIANPDOMK-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 | furans |
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| Subclass | furans |
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| Direct Parent | furans |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alkanolaminesaromatic alcoholsdialkylaminesheteroaromatic compoundshydrocarbon derivativesorganooxygen compoundsorganopnictogen compoundsoxacyclic compounds |
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| Substituents | aromatic alcoholfuransecondary aliphatic aminearomatic heteromonocyclic compoundheteroaromatic compoundsecondary amineoxacycleorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundaminealkanolamine |
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