Account TF-3'-G-cThea
- Catalog No. :
- ACLBWM785
- CAS No. :
- 2868305-75-1
- Molecular Formula :
- C42H37NO17
- Molecular Weight :
- 827.75
IUPAC Name:(2R,3R)-2-(1-((2R,3R)-6-(1-ethyl-5-oxopyrrolidin-2-yl)-3,5,7-trihydroxychroman-2-yl)-3,4,6-trihydroxy-5-oxo-5H-benzo[7]annulen-8-yl)-5,7-dihydroxychroman-3-yl 3,4,5-trihydroxybenzoate
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Product Information
| Product Name | TF-3'-G-cThea |
|---|---|
| IUPAC Name | (2R,3R)-2-(1-((2R,3R)-6-(1-ethyl-5-oxopyrrolidin-2-yl)-3,5,7-trihydroxychroman-2-yl)-3,4,6-trihydroxy-5-oxo-5H-benzo[7]annulen-8-yl)-5,7-dihydroxychroman-3-yl 3,4,5-trihydroxybenzoate |
| Molecular Formula | C42H37NO17 |
| Molecular Weight | 827.75 |
| SMILES | O=C(O[C@H]1[C@@H](C(C=C(C([C@@H]2[C@H](O)CC3=C(O2)C=C(O)C(C(CC4)N(CC)C4=O)=C3O)=CC(O)=C5O)C5=C6O)=CC6=O)OC7=C(C(O)=CC(O)=C7)C1)C8=CC(O)=C(O)C(O)=C8 |
| InChI Key | QWVULIVGRMJNMP-DEIQNALXSA-N |
| Synonym | TF-3-G-cThea;Benzoic acid, 3,4,5-trihydroxy-, (2R,3R)-2-[1-[(2R,3R)-6-(1-ethyl-5-oxo-2-pyrrolidinyl)-3,4-dihydro-3,5,7-trihydroxy-2H-1-benzopyran-2-yl]-3,4,5-trihydroxy-6-oxo-6H-benzocyclohepten-8-yl]-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester |
| CAS No. | 2868305-75-1 |
Synthetic Route by SureRoute
2. ACLBWM785 Molecular Building Block Synthetic Route
Theaflavine-3,3'-digallate
Theaflavin-3-gallate
(2R,3R)-5,7-Dihydroxy-2-(3,4,6-trihydroxy-5-oxo-8-((2R,3R)-3,5,7-trihydroxychroman-2-yl)-5H-benzo[7]annulen-1-yl)chroman-3-yl 3,4,5-trihydroxybenzoate