| Record Information |
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| Version | 2.0 |
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| Created at | 2022-04-28 01:57:18 UTC |
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| Updated at | 2022-04-28 01:57:18 UTC |
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| NP-MRD ID | NP0056073 |
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| Secondary Accession Numbers | None |
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| Natural Product Identification |
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| Common Name | Epicatechin 5,3'-dimethyl ether |
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| Description | Epicatechin 5,3'-dimethyl ether belongs to the class of organic compounds known as catechins. Catechins are compounds containing a catechin moiety, which is a 3,4-dihydro-2-chromene-3,5.7-Tiol. Epicatechin 5,3'-dimethyl ether is found in Cinnamomum cassia , Cinnamomum obtusifolium, Lindera umbellata and Lindera umbellata var. membranacea . Based on a literature review very few articles have been published on Epicatechin 5,3'-dimethyl ether. |
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| Structure | |
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| Synonyms | Not Available |
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| Chemical Formula | C17H18O6 |
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| Average Mass | 318.3250 Da |
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| Monoisotopic Mass | 318.11034 Da |
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| IUPAC Name | (2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-5-methoxy-3,4-dihydro-2H-1-benzopyran-3,7-diol |
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| Traditional Name | (2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-5-methoxy-3,4-dihydro-2H-1-benzopyran-3,7-diol |
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| CAS Registry Number | Not Available |
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| SMILES | Not Available |
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| InChI Identifier | Not Available |
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| InChI Key | BVMRDMUAFYCABS-CXAGYDPISA-N |
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| Experimental Spectra |
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| Not Available | | Predicted Spectra |
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| Not Available | | Chemical Shift Submissions |
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| Not Available | | Species |
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| Species of Origin | |
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| Chemical Taxonomy |
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| Description | Belongs to the class of organic compounds known as catechins. Catechins are compounds containing a catechin moiety, which is a 3,4-dihydro-2-chromene-3,5.7-Tiol. |
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| Kingdom | Organic compounds |
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| Super Class | Phenylpropanoids and polyketides |
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| Class | Flavonoids |
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| Sub Class | Flavans |
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| Direct Parent | Catechins |
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| Alternative Parents | |
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| Substituents | - Catechin
- 3p-methoxyflavonoid-skeleton
- 5-methoxyflavonoid-skeleton
- 3-hydroxyflavonoid
- 4'-hydroxyflavonoid
- 7-hydroxyflavonoid
- Hydroxyflavonoid
- Chromane
- Benzopyran
- 1-benzopyran
- Methoxyphenol
- Phenoxy compound
- Anisole
- Methoxybenzene
- Phenol ether
- 1-hydroxy-2-unsubstituted benzenoid
- Alkyl aryl ether
- Phenol
- Benzenoid
- Monocyclic benzene moiety
- Secondary alcohol
- Ether
- Organoheterocyclic compound
- Oxacycle
- Organic oxygen compound
- Alcohol
- Organooxygen compound
- Hydrocarbon derivative
- Aromatic heteropolycyclic compound
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| Molecular Framework | Aromatic heteropolycyclic compounds |
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| External Descriptors | |
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| Physical Properties |
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| State | Not Available |
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| Experimental Properties | | Property | Value | Reference |
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| Melting Point | Not Available | Not Available | | Boiling Point | Not Available | Not Available | | Water Solubility | Not Available | Not Available | | LogP | Not Available | Not Available |
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| Predicted Properties | Not Available |
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