Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:25:27 UTC |
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Update Date | 2025-03-21 18:38:58 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00123368 |
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Frequency | 20.9 |
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Structure | |
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Chemical Formula | C7H10O4 |
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Molecular Mass | 158.0579 |
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SMILES | CC1OC(=O)CCC1C(=O)O |
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InChI Key | HLMWNUZNUHNFIW-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 | carbonyl compoundscarboxylic acid esterscarboxylic acidsdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesoxacyclic compoundsoxanes |
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Substituents | carbonyl groupcarboxylic aciddelta valerolactonecarboxylic acid derivativeoxacycleorganic oxideorganic oxygen compoundcarboxylic acid esteraliphatic heteromonocyclic compounddicarboxylic acid or derivativeshydrocarbon derivativeoxanedelta_valerolactoneorganooxygen compound |
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