| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:17:14 UTC |
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| Update Date | 2025-03-25 01:00:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02240638 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C23H29NO3 |
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| Molecular Mass | 367.2147 |
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| SMILES | CC(C)(C(=O)O)c1ccc(CN2CCC(C(O)c3ccccc3)CC2)cc1 |
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| InChI Key | HREZYAHXZXFIIB-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 | piperidines |
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| Subclass | benzylpiperidines |
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| Direct Parent | n-benzylpiperidines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | amino acidsaralkylaminesaromatic alcoholsazacyclic compoundsbenzylaminescarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundsphenylmethylaminesphenylpropanessecondary alcoholstrialkylamines |
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| Substituents | aromatic alcoholmonocyclic benzene moietycarbonyl groupcarboxylic acidaromatic heteromonocyclic compoundamino acid or derivativesamino acidcarboxylic acid derivativearalkylaminephenylpropaneorganic oxideorganonitrogen compoundorganopnictogen compoundtertiary aminealcoholazacycletertiary aliphatic aminen-benzylpiperidinemonocarboxylic acid or derivativesphenylmethylamineorganic oxygen compoundbenzylaminesecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compoundamineorganooxygen compound |
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