| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:05:33 UTC |
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| Update Date | 2025-03-25 00:55:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02214207 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H20O |
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| Molecular Mass | 192.1514 |
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| SMILES | CCc1cc(CC(C)(C)O)ccc1C |
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| InChI Key | ZMNMDRZWNJLJSD-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 | benzene and substituted derivatives |
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| Subclass | phenylpropanes |
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| Direct Parent | phenylpropanes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | hydrocarbon derivativestertiary alcoholstoluenes |
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| Substituents | phenylpropanealcoholaromatic homomonocyclic compoundtertiary alcoholorganic oxygen compoundhydrocarbon derivativetolueneorganooxygen compound |
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