| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:39:40 UTC |
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| Update Date | 2025-03-21 17:58:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00014684 |
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| Frequency | 299.7 |
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| Structure | |
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| Chemical Formula | C8H11NO3 |
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| Molecular Mass | 169.0739 |
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| SMILES | CN(C)Cc1ccc(C(=O)O)o1 |
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| InChI Key | LLPIDIFMBNAYOD-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbohydrates and carbohydrate conjugates |
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| Direct Parent | furanoid amino acids and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | amino acidsaralkylaminescarboxylic acidsfuroic acidsheteroaromatic compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundstrialkylamines |
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| Substituents | furancarboxylic acidaromatic heteromonocyclic compoundamino acid or derivativesamino acidcarboxylic acid derivativearalkylamineorganic oxideorganonitrogen compoundorganopnictogen compoundfuranoid amino acidtertiary amineorganoheterocyclic compoundfuroic acid or derivativesheteroaromatic compoundtertiary aliphatic aminefuroic acidoxacyclemonocarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundamine |
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