| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:54:57 UTC |
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| Update Date | 2025-03-25 00:51:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02189838 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C33H33N3O4 |
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| Molecular Mass | 535.2471 |
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| SMILES | C=Cc1c(C)c2cc3nc-3cc3[nH]c(cc4nc(cc1c(C)c2CCC(=O)O)C(C)=C4C)c(CCC(=O)O)c3C |
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| InChI Key | KMQFWDXWARILLC-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | Not Available |
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| Subclass | benzenoids |
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| Direct Parent | benzenoids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrroles |
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| Substituents | carbonyl groupcarboxylic acidazacycleheteroaromatic compoundcarboxylic acid derivativeorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compounddicarboxylic acid or derivativesorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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