| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:06:40 UTC |
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| Update Date | 2025-03-25 00:56:11 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02216721 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C21H24N2O7 |
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| Molecular Mass | 416.1584 |
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| SMILES | CCC1=C(C)C(=O)NC1Cc1[nH]c(C=C2OC(O)=C(O)C2=O)c(CCC(=O)O)c1C |
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| InChI Key | CZZZLYRHUZAIAY-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 | dihydrofurans |
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| Subclass | furanones |
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| Direct Parent | furanones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarboxylic acidscyclic ketonesheteroaromatic compoundshydrocarbon derivativeslactamsmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspyrrolespyrrolinessecondary carboxylic acid amidesvinylogous acidsvinylogous esters |
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| Substituents | carbonyl grouplactamcarboxylic acidaromatic heteromonocyclic compoundcyclic ketonecarboxylic acid derivativeketoneorganic oxideorganonitrogen compoundorganopnictogen compoundazacyclevinylogous esterheteroaromatic compoundcarboxamide groupoxacyclesecondary carboxylic acid amidevinylogous acidmonocarboxylic acid or derivativesorganic oxygen compoundpyrrolinepyrrolehydrocarbon derivativeorganic nitrogen compound3-furanoneorganooxygen compound |
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