| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:39:11 UTC |
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| Update Date | 2025-03-25 00:46:12 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02153955 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C19H21NO4 |
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| Molecular Mass | 327.1471 |
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| SMILES | COc1ccc2c3c1OC1C(O)C=CC(=O)C4C3C1(CCN4C)C2 |
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| InChI Key | ICKVCISGLGGQRC-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 | benzopyrans |
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| Subclass | 1-benzopyrans |
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| Direct Parent | 1-benzopyrans |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersanisolesazacyclic compoundshydrocarbon derivativesindanesketonesorganic oxidesorganopnictogen compoundsoxacyclic compoundspiperidinessecondary alcoholstrialkylamines |
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| Substituents | phenol ethercarbonyl groupether1-benzopyranalkyl aryl etherketoneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundpiperidinetertiary aminealcoholazacycletertiary aliphatic amineoxacycleorganic oxygen compoundanisoleindanesecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compoundamineorganooxygen compound |
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