| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:46 UTC |
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| Update Date | 2025-03-25 00:47:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02161891 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C35H31N3O7 |
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| Molecular Mass | 605.2162 |
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| SMILES | C=CC1=C(C)C(=CC2=NC(=Cc3[nH]c(C=C4C(=O)C(=O)c5ccccc54)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O |
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| InChI Key | YRLYMGJMEJBQSQ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | pyrroles |
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| Subclass | substituted pyrroles |
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| Direct Parent | dipyrrins |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aryl ketonesazacyclic compoundscarboxylic acidscyclic ketonesdicarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesindanonesketimineslactamsorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundspyrrolespyrrolinessecondary carboxylic acid amides |
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| Substituents | ketiminecarbonyl grouplactamcarboxylic acidiminecyclic ketonecarboxylic acid derivativepropargyl-type 1,3-dipolar organic compoundketonedipyrrinorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundazacycleheteroaromatic compoundindanoneorganic 1,3-dipolar compoundcarboxamide groupsecondary carboxylic acid amideorganic oxygen compoundpyrrolineindanedicarboxylic acid or derivativeshydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compoundaryl ketone |
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