| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:43:18 UTC |
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| Update Date | 2025-03-25 00:47:38 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02163118 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H6O6 |
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| Molecular Mass | 174.0164 |
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| SMILES | O=C(O)C1=C(O)C(O)COC1=O |
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| InChI Key | NFPOVEHRIXTBPC-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 | carbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesdihydropyranonesenoate estershydrocarbon derivativeslactonesorganic oxidesoxacyclic compoundssecondary alcoholsvinylogous acids |
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| Substituents | enoate esteralcoholcarbonyl groupcarboxylic acidpyran carboxylic acid or derivativesdihydropyranonecarboxylic acid derivativelactoneoxacyclealpha,beta-unsaturated carboxylic estervinylogous acidorganic oxideorganic oxygen compoundcarboxylic acid esteraliphatic heteromonocyclic compoundsecondary alcoholpyranonedicarboxylic acid or derivativeshydrocarbon derivativeorganooxygen compound |
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