| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:52:49 UTC |
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| Update Date | 2025-03-25 00:51:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02184898 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H15N3O2 |
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| Molecular Mass | 221.1164 |
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| SMILES | N=C(N)NCCC(=O)C(O)c1ccccc1 |
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| InChI Key | OMGRYTUDWQHRNI-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 | phenylbutylamines |
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| Direct Parent | phenylbutylamines |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | acyloinsalpha-hydroxy ketonesaromatic alcoholscarboximidamidesguanidineshydrocarbon derivativesiminesmonosaccharidesorganic oxidesorganopnictogen compoundssecondary alcohols |
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| Substituents | aromatic alcoholalcoholcarbonyl groupguanidineiminemonosaccharidecarboximidamidealpha-hydroxy ketoneketonearomatic homomonocyclic compoundsaccharideorganic oxidephenylbutylamineorganic oxygen compoundacyloinorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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