| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 13:09:13 UTC |
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| Update Date | 2025-03-24 21:56:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01941281 |
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| Frequency | 0.6 |
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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 | O=C(O)C12CCC(CO1)C2 |
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| InChI Key | KENMFOIQIMXSJA-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 heteropolycyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidsdialkyl ethershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsoxanestetrahydrofurans |
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| Substituents | carbonyl groupethercarboxylic acidpyran carboxylic acid or derivativestetrahydrofurancarboxylic acid derivativedialkyl etheraliphatic heteropolycyclic compoundoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeoxaneorganooxygen compound |
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