| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:49:38 UTC |
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| Update Date | 2025-03-25 00:49:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02177708 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C17H19N3O |
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| Molecular Mass | 281.1528 |
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| SMILES | N#Cc1ccc2c(C(O)C3CC4CCN3CC4)c[nH]c2c1 |
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| InChI Key | HQKSPJIZBQCYTL-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 | indoles and derivatives |
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| Subclass | indoles |
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| Direct Parent | indoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1,2-aminoalcoholsaromatic alcoholsazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesnitrilesorganopnictogen compoundspiperidinespyrrolesquinuclidinessecondary alcoholstrialkylamines |
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| Substituents | aromatic alcoholnitrileindolequinuclidinearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundpiperidinecarbonitriletertiary aminealcoholazacycle1,2-aminoalcoholheteroaromatic compoundtertiary aliphatic amineorganic oxygen compoundpyrrolesecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compoundamineorganooxygen compound |
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