| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:53:36 UTC |
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| Update Date | 2025-03-21 18:03:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00047218 |
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| Frequency | 70.6 |
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| Structure | |
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| Chemical Formula | C17H16O6 |
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| Molecular Mass | 316.0947 |
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| SMILES | COc1cc(CC2COc3cc(O)cc(O)c3C2=O)ccc1O |
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| InChI Key | CYYQUXXBVFGDHL-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | phenylpropanoids and polyketides |
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| Class | homoisoflavonoids |
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| Subclass | homoisoflavans |
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| Direct Parent | homoisoflavanones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsalkyl aryl ethersanisolesaryl alkyl ketoneschromoneshydrocarbon derivativesisoflavanonesisoflavonoidsmethoxybenzenesmethoxyphenolsorganic oxidesoxacyclic compoundsphenoxy compoundsvinylogous acids |
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| Substituents | phenol ethermonocyclic benzene moietyetheraryl alkyl ketone1-benzopyran1-hydroxy-2-unsubstituted benzenoidmethoxyphenolalkyl aryl etherisoflavanoneketoneorganic oxidechromonearomatic heteropolycyclic compoundisoflavonoidchromaneorganoheterocyclic compoundbenzopyran1-hydroxy-4-unsubstituted benzenoidmethoxybenzeneoxacyclevinylogous acidorganic oxygen compoundanisolephenolhomoisoflavanonehydrocarbon derivativebenzenoidphenoxy compoundorganooxygen compoundaryl ketone |
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