| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:13:31 UTC |
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| Update Date | 2025-03-25 00:58:41 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02232197 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C33H45N3O10 |
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| Molecular Mass | 643.3105 |
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| SMILES | CCC1=C(C)C(=O)NC1Cc1[nH]c(Cc2c(CCC(=O)O)c(C)c(CCC(=O)O)n2CCC(O)CC(=O)O)c(CCC(=O)O)c1C |
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| InChI Key | RXTGANGZSHUVCP-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 | azacyclic compoundsbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolinessecondary alcoholssecondary carboxylic acid amidessubstituted pyrroles |
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| Substituents | carbonyl grouplactamcarboxylic acidaromatic heteromonocyclic compoundsubstituted pyrrolebeta-hydroxy acidorganic oxideorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundalcoholazacycleheteroaromatic compoundtetracarboxylic acid or derivativeshydroxy acidcarboxamide groupsecondary carboxylic acid amideorganic oxygen compoundpyrrolinepyrrolesecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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