| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:15:45 UTC |
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| Update Date | 2025-03-21 18:34:15 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00099883 |
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| Frequency | 27.5 |
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| Structure | |
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| Chemical Formula | C14H16N2O3 |
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| Molecular Mass | 260.1161 |
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| SMILES | CN1C2CC(OC(=O)c3cccnc3)CC1C1OC12 |
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| InChI Key | BCJRTTXNXWQZEL-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 | pyridinecarboxylic acids and derivatives |
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| Direct Parent | pyridine-3-carboxylic acids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | amino acids and derivativesazacyclic compoundscarboxylic acid estersdialkyl ethersepoxidesheteroaromatic compoundshydrocarbon derivativesmethylpyridinesmonocarboxylic acids and derivativesmorpholinesn-alkylpyrrolidinesorganic oxidesorganopnictogen compoundsoxacyclic compoundspiperidinestrialkylamines |
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| Substituents | etheramino acid or derivativespyridine-3-carboxylic acidcarboxylic acid derivativedialkyl etherorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundpyrrolidinepiperidinetertiary amineazacyclen-alkylpyrrolidineheteroaromatic compoundtertiary aliphatic amineoxiranemethylpyridineoxazinaneoxacyclemorpholinemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterhydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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