| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:06:39 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 | DMID02216692 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C30H44N4O7 |
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| Molecular Mass | 572.321 |
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| SMILES | CCC1C(C)C(=O)NC(Cc2[nH]c(Cc3[nH]c(CC(N)C(=O)O)c(C)c3CCC(=O)O)c(CCC(=O)O)c2C)C1C |
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| InChI Key | XJSLABBPLGENIF-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 | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidsdelta lactamsheteroaromatic compoundshydrocarbon derivativesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspiperidinonespyrrolessecondary carboxylic acid amidestricarboxylic acids and derivatives |
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| Substituents | carbonyl grouplactamcarboxylic acidaromatic heteromonocyclic compoundtricarboxylic acid or derivativesorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundpiperidinonepiperidineorganoheterocyclic compoundazacycleheteroaromatic compoundcarboxamide groupdelta-lactamsecondary carboxylic acid amideorganic oxygen compoundpyrrolehydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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