| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:39:02 UTC |
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| Update Date | 2025-03-25 00:46:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02153557 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C21H23NO4 |
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| Molecular Mass | 353.1627 |
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| SMILES | COc1ccc(C2c3cc4c(cc3C3CCN(C)C32)OCO4)cc1OC |
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| InChI Key | XTLZANBSZOVEIX-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 | acetalsalkyl aryl ethersanisolesazacyclic compoundsbenzodioxolesdimethoxybenzeneshydrocarbon derivativesindanesn-alkylpyrrolidinesorganopnictogen compoundsoxacyclic compoundsphenoxy compoundstrialkylamines |
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| Substituents | phenol etheretheralkyl aryl etherdimethoxybenzeneacetalaromatic heteropolycyclic compoundo-dimethoxybenzeneorganonitrogen compoundorganopnictogen compoundpyrrolidinetertiary amineorganoheterocyclic compoundbenzodioxoleazacyclen-alkylpyrrolidinetertiary aliphatic aminemethoxybenzeneoxacycleorganic oxygen compoundanisolebenzazocineindanehydrocarbon derivativeorganic nitrogen compoundphenoxy compoundamineorganooxygen compound |
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