| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:04:58 UTC |
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| Update Date | 2025-03-25 00:55:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02212879 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C35H50N4O7S |
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| Molecular Mass | 670.34 |
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| SMILES | CCCCCC1=C(C)C(Cc2[nH]c(Cc3[nH]c(CC4NC(=O)C(C)=C4CC)c(C)c3CCC(=O)O)c(CCC(=O)O)c2C)NS1(=O)=O |
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| InChI Key | GGIMKMIFMVQVFQ-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 | dicarboxylic acids and derivatives |
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| Direct Parent | dicarboxylic acids and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganic sulfonamidesorganonitrogen compoundsorganopnictogen compoundsorganosulfonamidespyrrolespyrrolinessecondary carboxylic acid amidesthiazolines |
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| Substituents | organosulfonic acid or derivativescarbonyl grouplactamcarboxylic acidaromatic heteromonocyclic compoundorganosulfonic acid amideorganic oxideorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundazacycleheteroaromatic compoundcarboxamide groupsecondary carboxylic acid amideorganic oxygen compoundpyrrolineorganic sulfonic acid or derivativespyrroleortho-thiazolinedicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundorganic sulfonic acid amideorganooxygen compound |
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