| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:44:13 UTC |
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| Update Date | 2025-03-25 00:47:58 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02165248 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C18H17NO4 |
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| Molecular Mass | 311.1158 |
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| SMILES | CC1c2ccc(O)cc2OC(c2c[nH]c3ccc(O)cc23)C1O |
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| InChI Key | JEKFRPCQAGVZTA-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 | 1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesindolesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspyrrolessecondary alcohols |
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| Substituents | alcoholetherazacycle1-benzopyranindoleheteroaromatic compound1-hydroxy-2-unsubstituted benzenoidindole or derivativesalkyl aryl etheroxacycleorganic oxygen compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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