| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:16:35 UTC |
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| Update Date | 2025-03-25 00:38:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02101297 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C8H12O2 |
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| Molecular Mass | 140.0837 |
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| SMILES | CC12CCC(CO1)CC2=O |
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| InChI Key | QRVWDICUCHUTIR-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 | oxanes |
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| Subclass | oxanes |
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| Direct Parent | oxanes |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | dialkyl ethershydrocarbon derivativesketonesorganic oxidesoxacyclic compounds |
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| Substituents | carbonyl groupetherdialkyl etherketonealiphatic heteropolycyclic compoundoxacycleorganic oxideorganic oxygen compoundhydrocarbon derivativeoxaneorganooxygen compound |
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