| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:07:45 UTC |
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| Update Date | 2025-03-25 00:56:34 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02219265 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H15NO |
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| Molecular Mass | 189.1154 |
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| SMILES | COc1ccc2c(c1)CC1NCCC21 |
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| InChI Key | SHPCBBNEFXKJAN-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 | benzene and substituted derivatives |
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| Subclass | benzazocines |
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| Direct Parent | benzazocines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersanisolesazacyclic compoundsdialkylamineshydrocarbon derivativesindanesorganopnictogen compoundspyrrolidines |
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| Substituents | phenol ethersecondary aliphatic amineetherazacyclealkyl aryl ethersecondary amineorganic oxygen compoundaromatic heteropolycyclic compoundanisolebenzazocineindaneorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundpyrrolidineorganoheterocyclic compoundorganooxygen compoundamine |
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