| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:06:37 UTC |
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| Update Date | 2025-03-25 00:56:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02216610 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C33H42N4O9 |
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| Molecular Mass | 638.2952 |
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| SMILES | CCC1C(=O)NC(Cc2[nH]c(Cc3[nH]c(C=C4C=C(C(=O)O)NC(C(=O)O)C4)c(C)c3CCC(=O)O)c(CCC(=O)O)c2C)C1C |
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| InChI Key | XOAGWSNKFDEZJW-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 | tetracarboxylic acids and derivatives |
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| Direct Parent | tetracarboxylic acids and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsamino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsdialkylaminesheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganopnictogen compoundspyrrolespyrrolidine-2-onessecondary carboxylic acid amidestetrahydropyridines |
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| Substituents | 2-pyrrolidonecarbonyl grouplactamcarboxylic acidaromatic heteromonocyclic compoundamino acid or derivativesamino acidalpha-amino acid or derivativesorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundpyrrolidinepyrrolidoneorganoheterocyclic compoundsecondary aliphatic amineazacycleheteroaromatic compoundtetrahydropyridinetetracarboxylic acid or derivativessecondary aminecarboxamide groupsecondary carboxylic acid amideorganic oxygen compoundpyrrolehydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
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