| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:15:19 UTC |
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| Update Date | 2025-03-21 18:34:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00098836 |
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| Frequency | 27.8 |
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| Structure | |
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| Chemical Formula | C10H9NO2 |
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| Molecular Mass | 175.0633 |
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| SMILES | COc1ccc2c(C=O)c[nH]c2c1 |
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| InChI Key | JTEFJNIWWXTBMP-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 | indoles and derivatives |
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| Subclass | indolecarboxylic acids and derivatives |
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| Direct Parent | indolecarboxylic acids and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersanisolesaryl-aldehydesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesindolesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolesvinylogous amides |
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| Substituents | indolecarboxylic acid derivativevinylogous amidephenol etheretherazacycleindoleheteroaromatic compoundaldehydealkyl aryl etherorganic oxidearyl-aldehydeorganic oxygen compoundaromatic heteropolycyclic compoundanisolepyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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