| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:15:23 UTC |
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| Update Date | 2025-03-21 18:34:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00099016 |
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| Frequency | 27.8 |
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| Structure | |
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| Chemical Formula | C15H17NO3 |
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| Molecular Mass | 259.1208 |
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| SMILES | COc1cc2c(c3c1CN(C)CC3)C1C=COC1O2 |
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| InChI Key | ZNBPGKUZWXOCNC-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 | tetrahydroisoquinolines |
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| Subclass | tetrahydroisoquinolines |
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| Direct Parent | tetrahydroisoquinolines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | acetalsalkyl aryl ethersanisolesaralkylaminesazacyclic compoundscoumaransdihydrofuranshydrocarbon derivativesorganopnictogen compoundsoxacyclic compoundstrialkylamines |
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| Substituents | phenol etheretherazacycletertiary aliphatic aminealkyl aryl etheraralkylamineoxacycleorganic oxygen compoundacetalaromatic heteropolycyclic compoundanisoleorganonitrogen compoundtetrahydroisoquinolineorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundaminetertiary aminecoumaranorganooxygen compounddihydrofuran |
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