| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:05:07 UTC |
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| Update Date | 2025-03-25 00:55:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02213227 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H13NO |
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| Molecular Mass | 175.0997 |
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| SMILES | CN1CC2CC1c1ccccc1O2 |
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| InChI Key | QPZMBSAHGVAYND-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | benzopyrans |
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| Subclass | 1-benzopyrans |
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| Direct Parent | 1-benzopyrans |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1,4-oxazepinesalkyl aryl ethersaralkylaminesazacyclic compoundsbenzenoidshydrocarbon derivativesn-alkylpyrrolidinesorganopnictogen compoundsoxacyclic compoundstrialkylamines |
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| Substituents | etherazacycle1-benzopyrann-alkylpyrrolidinetertiary aliphatic aminealkyl aryl etheraralkylaminepara-oxazepineoxacycleorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundpyrrolidineaminetertiary amineorganooxygen compound |
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