| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 09:51:17 UTC |
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| Update Date | 2025-03-24 20:30:15 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01468669 |
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| Frequency | 0.9 |
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| Structure | |
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| Chemical Formula | C7H12O3 |
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| Molecular Mass | 144.0786 |
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| SMILES | CC1(C=O)CC(O)CCO1 |
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| InChI Key | YPKGMODZTKMWSP-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 | aldehydesdialkyl ethershydrocarbon derivativesorganic oxidesoxacyclic compoundsoxanespyranssecondary alcohols |
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| Substituents | alcoholcarbonyl groupetherpyran carboxylic acid or derivativesaldehydedialkyl etheroxacycleorganic oxideorganic oxygen compoundaliphatic heteromonocyclic compoundsecondary alcoholhydrocarbon derivativeoxaneorganooxygen compound |
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