| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:30:54 UTC |
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| Update Date | 2025-03-21 18:41:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00136128 |
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| Frequency | 18.4 |
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| Structure | |
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| Chemical Formula | C10H11NO2 |
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| Molecular Mass | 177.079 |
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| SMILES | O=C(O)C1(c2ccccc2)CNC1 |
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| InChI Key | MRDBMBGOIZGIDB-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 | azetidines |
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| Subclass | phenylazetidines |
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| Direct Parent | phenylazetidines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | amino acidsazacyclic compoundsazetidinecarboxylic acidsbenzene and substituted derivativescarbonyl compoundscarboxylic acidsdialkylamineshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compounds |
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| Substituents | monocyclic benzene moietycarbonyl groupcarboxylic acidaromatic heteromonocyclic compound3-phenylazetidineamino acid or derivativesamino acidazetidinecarboxylic acidcarboxylic acid derivativeorganic oxideorganonitrogen compoundorganopnictogen compoundsecondary aliphatic amineazacyclesecondary aminemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compoundamine |
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