| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:20:30 UTC |
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| Update Date | 2025-03-21 18:36:37 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00111569 |
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| Frequency | 23.8 |
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| Structure | |
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| Chemical Formula | C10H11NO3 |
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| Molecular Mass | 193.0739 |
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| SMILES | O=C1CC(O)CC(c2cccnc2)O1 |
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| InChI Key | KVISSKWYSCEKQI-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 | lactones |
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| Subclass | delta valerolactones |
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| Direct Parent | delta valerolactones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acid estersheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanessecondary alcohols |
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| Substituents | carbonyl grouparomatic heteromonocyclic compounddelta valerolactonecarboxylic acid derivativeorganic oxideorganonitrogen compoundorganopnictogen compoundoxanedelta_valerolactonealcoholazacycleheteroaromatic compoundhydroxypyridineoxacyclemonocarboxylic acid or derivativespyridineorganic oxygen compoundcarboxylic acid estersecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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