| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:40:25 UTC |
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| Update Date | 2025-03-25 00:46:41 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02156724 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H14O3 |
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| Molecular Mass | 242.0943 |
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| SMILES | O=C1CCC(O)(c2ccc3ccccc3c2)CO1 |
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| InChI Key | XLRBOJJNNGBCBV-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | naphthalenes |
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| Subclass | naphthalenes |
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| Direct Parent | naphthalenes |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acid estersdelta valerolactoneshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsoxanestertiary alcohols |
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| Substituents | alcoholcarbonyl groupdelta valerolactonecarboxylic acid derivativelactoneoxacycletertiary alcoholorganic oxidemonocarboxylic acid or derivativesnaphthaleneorganic oxygen compoundaromatic heteropolycyclic compoundcarboxylic acid esterhydrocarbon derivativeoxanedelta_valerolactoneorganoheterocyclic compoundorganooxygen compound |
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