| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:13:16 UTC |
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| Update Date | 2025-03-25 00:58:34 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02231596 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H10O4 |
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| Molecular Mass | 170.0579 |
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| SMILES | CC1OC(=O)CC2OC(=O)CC12 |
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| InChI Key | YVWHERUCQXBSQD-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 heteropolycyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acid estersdicarboxylic acids and derivativesgamma butyrolactoneshydrocarbon derivativesorganic oxidesoxacyclic compoundsoxanestetrahydrofurans |
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| Substituents | carbonyl grouptetrahydrofurandelta valerolactonecarboxylic acid derivativegamma butyrolactonealiphatic heteropolycyclic compoundoxacycleorganic oxideorganic oxygen compoundcarboxylic acid esterdicarboxylic acid or derivativeshydrocarbon derivativeoxanedelta_valerolactoneorganooxygen compound |
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