| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:52:56 UTC |
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| Update Date | 2025-03-25 00:51:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02185164 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H22N2O3 |
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| Molecular Mass | 254.163 |
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| SMILES | NC(=O)CCCCC1CC(C(=O)O)N2CCCC12 |
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| InChI Key | IMEDTIFHGDLXNN-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | alpha amino acids |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | amino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsfatty amideshydrocarbon derivativesmonocarboxylic acids and derivativesn-alkylpyrrolidinesorganic oxidesorganopnictogen compoundsprimary carboxylic acid amidespyrrolidine carboxylic acidspyrrolizidinestrialkylamines |
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| Substituents | primary carboxylic acid amidefatty acylcarbonyl groupcarboxylic acidamino acidfatty amidealiphatic heteropolycyclic compoundorganic oxidepyrrolidine carboxylic acidalpha-amino acidorganonitrogen compoundorganopnictogen compoundpyrrolidinetertiary amineorganoheterocyclic compoundazacyclen-alkylpyrrolidinetertiary aliphatic aminecarboxamide groupmonocarboxylic acid or derivativespyrrolidine carboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativepyrrolizidineorganic nitrogen compoundamineorganooxygen compound |
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