| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:50:55 UTC |
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| Update Date | 2025-03-25 00:50:23 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02180621 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H20O4 |
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| Molecular Mass | 252.1362 |
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| SMILES | Cc1c(C)c2c(c(C)c1O)CCC(O)(C(C)O)O2 |
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| InChI Key | HAIWEWLLNNCHAL-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 | 1-benzopyrans |
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| Direct Parent | 1-benzopyrans |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | benzenoidshemiacetalshydrocarbon derivativesoxacyclic compoundssecondary alcohols |
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| Substituents | alcohol1-benzopyranoxacycleorganic oxygen compoundaromatic heteropolycyclic compoundsecondary alcoholhemiacetalhydrocarbon derivativebenzenoidorganooxygen compound |
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