Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:17:14 UTC |
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Update Date | 2025-03-21 18:35:01 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00103581 |
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Frequency | 26.2 |
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Structure | |
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Chemical Formula | C7H10O3 |
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Molecular Mass | 142.063 |
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SMILES | CC(=O)C1CCCC(=O)O1 |
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InChI Key | QQKSFFSWFSDZDF-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 | aliphatic heteromonocyclic compounds |
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Alternative Parents | alpha-acyloxy ketonescarboxylic acid estershydrocarbon derivativesketonesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsoxanes |
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Substituents | carbonyl groupalpha-acyloxy ketonedelta valerolactonecarboxylic acid derivativeketoneoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esteraliphatic heteromonocyclic compoundhydrocarbon derivativeoxanedelta_valerolactoneorganooxygen compound |
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