| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:03:27 UTC |
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| Update Date | 2025-03-25 00:54:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02209191 |
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| Frequency | 0.5 |
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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 | CC1(c2cccnc2)OCCC1=O |
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| InChI Key | HCBALKSCMRWIFT-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 | pyridines and derivatives |
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| Subclass | methylpyridines |
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| Direct Parent | methylpyridines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscyclic ketonesdialkyl ethersfuranonesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundstetrahydrofurans |
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| Substituents | carbonyl groupetheraromatic heteromonocyclic compoundazacycletetrahydrofuranheteroaromatic compoundmethylpyridinecyclic ketonedialkyl etherketoneoxacycleorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compound3-furanoneorganooxygen compound |
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