| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:13:27 UTC |
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| Update Date | 2025-03-25 00:58:39 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02232019 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H8O3 |
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| Molecular Mass | 140.0473 |
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| SMILES | CC1=CCC(=O)OC1C=O |
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| InChI Key | NRXFRIJHPURSCC-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 | pyrans |
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| Subclass | pyran carboxylic acids and derivatives |
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| Direct Parent | pyran carboxylic acids |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | aldehydesalpha-acyloxy aldehydescarboxylic acid estersdihydropyranoneshydrocarbon derivativeslactonesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compounds |
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| Substituents | carbonyl grouppyran carboxylic acid or derivativesdihydropyranonealdehydecarboxylic acid derivativelactoneoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esteraliphatic heteromonocyclic compoundpyranonehydrocarbon derivativealpha-acyloxy aldehydeorganooxygen compound |
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