| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:39:19 UTC |
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| Update Date | 2025-03-25 00:46:15 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02154251 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H10O4S |
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| Molecular Mass | 238.03 |
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| SMILES | COc1cc(O)c2c(S(=O)O)cccc2c1 |
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| InChI Key | WGSAPNNUXWASAZ-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 homopolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsalkyl aryl ethersanisoleshydrocarbon derivativesorganic oxidesorganosulfur compoundssulfinic acids |
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| Substituents | phenol etherethersulfinic acid derivative1-hydroxy-2-unsubstituted benzenoidaromatic homopolycyclic compound1-hydroxy-4-unsubstituted benzenoidalkyl aryl etherorganosulfur compoundsulfinic acidorganic oxideorganic oxygen compoundanisolehydrocarbon derivative1-naphtholorganooxygen compound |
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