| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:18:18 UTC |
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| Update Date | 2025-03-25 01:00:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02243094 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C21H26N2O5 |
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| Molecular Mass | 386.1842 |
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| SMILES | C=CC1=C(C)C(Cc2[nH]c(CC3CCC(=O)O3)c(C)c2CCC(=O)O)NC1=O |
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| InChI Key | HVDDIEHUAVHJLW-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 | lactones |
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| Subclass | gamma butyrolactones |
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| Direct Parent | gamma butyrolactones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acid esterscarboxylic acidsdicarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspyrrolespyrrolinessecondary carboxylic acid amidestetrahydrofurans |
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| Substituents | carbonyl grouplactamcarboxylic acidaromatic heteromonocyclic compoundcarboxylic acid derivativeorganic oxideorganonitrogen compoundorganopnictogen compoundazacycletetrahydrofuranheteroaromatic compoundcarboxamide groupgamma butyrolactoneoxacyclesecondary carboxylic acid amideorganic oxygen compoundpyrrolinecarboxylic acid esterpyrroledicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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