Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:25:58 UTC |
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Update Date | 2025-03-21 18:39:12 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00124574 |
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Frequency | 20.6 |
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Structure | |
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Chemical Formula | C12H18O2 |
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Molecular Mass | 194.1307 |
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SMILES | CC(C)(C)c1ccc(C(O)CO)cc1 |
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InChI Key | NNPXCFIPWDBGNX-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 | 1,2-diolsaromatic alcoholshydrocarbon derivativesprimary alcoholssecondary alcohols |
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Substituents | aromatic alcoholalcoholphenylpropanearomatic homomonocyclic compoundorganic oxygen compoundsecondary alcoholhydrocarbon derivativeprimary alcoholorganooxygen compound1,2-diol |
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