| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 13:59:12 UTC |
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| Update Date | 2025-03-25 00:31:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02060195 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C55H64N8O11 |
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| Molecular Mass | 1012.4695 |
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| SMILES | C=CC1=C(C)C(=O)NC1=Cc1[nH]c(C=C2N=C(C=C3NC(=O)C(Cc4[nH]c(Cc5[nH]c(CC6NC(=O)C(C)=C6CC)c(C)c5CCC(=O)O)c(CCC(=O)O)c4C)N3)C(C)=C2CCC(=O)O)c(CCC(=O)O)c1C |
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| InChI Key | DKHQHGLVMQCVRF-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 acidsdialkylaminesdipyrrinsheteroaromatic compoundshydrocarbon derivativesimidazolidinonesketimineslactamsorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundspyrrolespyrrolinessecondary carboxylic acid amides |
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| Substituents | imidazolidineketiminecarbonyl grouplactamcarboxylic acidaromatic heteromonocyclic compoundamino acid or derivativesamino acidiminealpha-amino acid or derivativespropargyl-type 1,3-dipolar organic compounddipyrrinimidazolidinoneorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundsecondary aliphatic amineazacycleheteroaromatic compoundtetracarboxylic acid or derivativesorganic 1,3-dipolar compoundsecondary aminecarboxamide groupsecondary carboxylic acid amideorganic oxygen compoundpyrrolinepyrrolehydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
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