| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:06:40 UTC |
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| Update Date | 2025-03-25 00:56:11 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02216728 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C21H29NO4 |
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| Molecular Mass | 359.2097 |
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| SMILES | CCC1=C(C)C(=O)NC1CC1C(C)=C(CCC(=O)O)C(CC(C)=O)=C1C |
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| InChI Key | XUZFCPRDMNYYGM-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 | pyrrolines |
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| Subclass | pyrrolines |
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| Direct Parent | pyrrolines |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarboxylic acidshydrocarbon derivativesketoneslactamsmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | carbonyl grouplactamcarboxylic acidazacyclecarboxamide groupcarboxylic acid derivativeketonesecondary carboxylic acid amideorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundpyrrolinealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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