| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:39:04 UTC |
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| Update Date | 2025-03-25 00:46:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02153655 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H18N4O3 |
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| Molecular Mass | 302.1379 |
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| SMILES | COc1ccc(CC2CNc3[nH]c(N)nc(=O)c32)cc1OC |
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| InChI Key | ZEELWQONUNRFDZ-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 | methoxybenzenes |
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| Direct Parent | dimethoxybenzenes |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersanisolesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganopnictogen compoundsphenoxy compoundsprimary aminespyrimidonespyrrolespyrrolopyrimidinessecondary alkylarylaminesvinylogous amides |
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| Substituents | phenol etheretherpyrimidonealkyl aryl etherpyrimidinedimethoxybenzenepyrrolopyrimidineorganic oxidearomatic heteropolycyclic compoundo-dimethoxybenzeneorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundvinylogous amideazacycleheteroaromatic compoundsecondary aminesecondary aliphatic/aromatic amineorganic oxygen compoundanisolepyrrolehydrocarbon derivativeprimary amineorganic nitrogen compoundphenoxy compoundamineorganooxygen compound |
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