| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:20:32 UTC |
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| Update Date | 2025-03-25 01:01:17 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02248339 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H13NO |
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| Molecular Mass | 187.0997 |
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| SMILES | Cn1c(CO)ccc1-c1ccccc1 |
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| InChI Key | SQCQTSKPXYSZGD-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 | substituted pyrroles |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | aromatic alcoholsazacyclic compoundsbenzene and substituted derivativesheteroaromatic compoundshydrocarbon derivativesn-methylpyrrolesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | aromatic alcoholalcoholmonocyclic benzene moietyn-methylpyrrolearomatic heteromonocyclic compoundazacycleheteroaromatic compoundsubstituted pyrroleorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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