| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:35:43 UTC |
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| Update Date | 2025-03-21 17:57:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00005493 |
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| Frequency | 972.7 |
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| Structure | |
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| Chemical Formula | C11H17NO3 |
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| Molecular Mass | 211.1208 |
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| SMILES | CNCC(O)c1ccc(OC)c(OC)c1 |
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| InChI Key | QSUCQAULQIAOEP-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 | methoxybenzenes |
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| Direct Parent | dimethoxybenzenes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alkyl aryl ethersanisolesaromatic alcoholsdialkylamineshydrocarbon derivativesorganopnictogen compoundsphenoxy compoundssecondary alcohols |
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| Substituents | aromatic alcoholalcoholphenol ethersecondary aliphatic amineetheralkyl aryl ethersecondary aminearomatic homomonocyclic compounddimethoxybenzeneorganic oxygen compoundanisoleo-dimethoxybenzeneorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundphenoxy compoundorganooxygen compoundamine |
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