| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:04:16 UTC |
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| Update Date | 2025-03-25 00:55:12 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02211168 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H15N3O |
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| Molecular Mass | 205.1215 |
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| SMILES | CC(=O)N1CCC(c2cccnc2)NC1 |
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| InChI Key | CJCBPRVKMNQPFX-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 | acetamidesamino acids and derivativesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesdialkylaminesdiazinanesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganopnictogen compoundstertiary carboxylic acid amides |
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| Substituents | secondary aliphatic aminecarbonyl grouparomatic heteromonocyclic compoundazacycleamino acid or derivativesheteroaromatic compoundmethylpyridinesecondary aminecarboxamide groupcarboxylic acid derivative1,3-diazinaneorganic oxideorganic oxygen compoundtertiary carboxylic acid amideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundacetamideorganooxygen compoundamine |
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