Account Catechin 3-gallate
- Catalog No. :
- ACNVXE421
- CAS No. :
- 20819-16-3
- Molecular Formula :
- C22H18O10
- Molecular Weight :
- 442.38
IUPAC Name:(2R,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychroman-3-yl 3,4,5-trihydroxybenzoate
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Product Information
| Product Name | Catechin 3-gallate |
|---|---|
| IUPAC Name | (2R,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychroman-3-yl 3,4,5-trihydroxybenzoate |
| Molecular Formula | C22H18O10 |
| Molecular Weight | 442.38 |
| SMILES | OC1=C(O)C(O)=CC(C(O[C@H]2CC(C(O)=CC(O)=C3)=C3O[C@@H]2C4=CC(O)=C(O)C=C4)=O)=C1 |
| InChI Key | LSHVYAFMTMFKBA-PZJWPPBQSA-N |
| Synonym | (+/-)-Catechin-2,3,4-13C3 gallate >=99 atom % 13C, >=97% (CP);(+/-)-Catechin-2,3,4-13C3 gallate;Benzoic acid, 3,4,5-trihydroxy-, (2R,3S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester, rel- |
| CAS No. | 20819-16-3 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501
Synthetic Route by SureRoute
2. ACNVXE421 Molecular Building Block Synthetic Route
(2R,3R)-2-(3,4-Dihydroxyphenyl)-5,7-dihydroxychroman-3-yl 3,4,5-trihydroxybenzoate
(2R,3R)-5,7-Dihydroxy-2-(3,4,5-trihydroxyphenyl)chroman-3-yl 3,4,5-trihydroxybenzoate
(2S,3R)-5,7-Dihydroxy-2-(3,4,5-trihydroxyphenyl)chroman-3-yl 3,4,5-trihydroxybenzoate