| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:59:31 UTC |
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| Update Date | 2025-03-25 00:53:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02200158 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H12N2O2 |
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| Molecular Mass | 204.0899 |
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| SMILES | COC(=O)Cc1c[nH]c2c(N)cccc12 |
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| InChI Key | YMIGOTRZBPDNBT-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 | indoles |
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| Direct Parent | indoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | amino acids and derivativesazacyclic compoundsbenzenoidscarbonyl compoundsheteroaromatic compoundshydrocarbon derivativesmethyl estersmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundsprimary aminespyrroles |
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| Substituents | carbonyl groupazacycleamino acid or derivativesindoleheteroaromatic compoundcarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesmethyl esterorganic oxygen compoundaromatic heteropolycyclic compoundcarboxylic acid esterpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidprimary amineorganic nitrogen compoundamineorganooxygen compound |
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