| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:13:30 UTC |
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| Update Date | 2025-03-25 00:58:40 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02232139 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H16O4 |
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| Molecular Mass | 236.1049 |
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| SMILES | CCC1(C=O)OCCc2cc(O)c(OC)cc21 |
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| InChI Key | DTTAYCCAHHUVCY-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 | benzopyrans |
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| Subclass | 2-benzopyrans |
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| Direct Parent | 2-benzopyrans |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsaldehydesalkyl aryl ethersanisolesdialkyl ethershydrocarbon derivativesorganic oxidesoxacyclic compounds |
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| Substituents | phenol ethercarbonyl groupether1-hydroxy-2-unsubstituted benzenoidaldehydealkyl aryl etherdialkyl etheroxacycleorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundanisole2-benzopyranhydrocarbon derivativebenzenoidorganooxygen compound |
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