| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:54:57 UTC |
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| Update Date | 2025-03-25 00:51:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02189834 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H16 |
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| Molecular Mass | 172.1252 |
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| SMILES | C=Cc1c(C)ccc(C(=C)C)c1C |
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| InChI Key | BMTBNQYSTJVPRY-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 | phenylpropenes |
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| Direct Parent | phenylpropenes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | branched unsaturated hydrocarbonscyclic olefinsunsaturated aliphatic hydrocarbonsm-xylenes |
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| Substituents | cyclic olefinm-xyleneolefinhydrocarbonunsaturated hydrocarbonaromatic homomonocyclic compoundxylenebranched unsaturated hydrocarbonphenylpropeneunsaturated aliphatic hydrocarbon |
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