| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:14:49 UTC |
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| Update Date | 2025-03-25 00:59:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02235195 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H7NO3 |
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| Molecular Mass | 201.0426 |
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| SMILES | O=c1[nH]c2c(ccc3cc(O)ccc32)o1 |
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| InChI Key | LBSMURYGRRPTPN-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 | naphthalenes |
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| Subclass | naphthols and derivatives |
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| Direct Parent | naphthols and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsazacyclic compoundsbenzoxazolonesheteroaromatic compoundshydrocarbon derivativesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundsoxazoles |
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| Substituents | carbonic acid derivativeazacyclebenzoxazoleheteroaromatic compoundoxazole1-hydroxy-2-unsubstituted benzenoidbenzoxazoloneoxacycleorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compound2-naphtholorganoheterocyclic compoundorganooxygen compoundazole |
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