Account (2S,3R,4S,5R,6R)-6-(((3,4-Dihydroxy-5-((3,4,5-trihydroxybenzoyl)oxy)benzoyl)oxy)methyl)tetrahydro-2H-pyran-2,3,4,5-tetrayl tetrakis(3,4-dihydroxy-5-((3,4,5-trihydroxybenzoyl)oxy)benzoate)
- Catalog No. :
- ACLCOS530
- CAS No. :
- 5424-20-4
- Molecular Formula :
- C76H52O46
- Molecular Weight :
- 1701.21
IUPAC Name:(2S,3R,4S,5R,6R)-6-(((3,4-dihydroxy-5-((3,4,5-trihydroxybenzoyl)oxy)benzoyl)oxy)methyl)tetrahydro-2H-pyran-2,3,4,5-tetrayl tetrakis(3,4-dihydroxy-5-((3,4,5-trihydroxybenzoyl)oxy)benzoate)
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Product Information
| Product Name | (2S,3R,4S,5R,6R)-6-(((3,4-Dihydroxy-5-((3,4,5-trihydroxybenzoyl)oxy)benzoyl)oxy)methyl)tetrahydro-2H-pyran-2,3,4,5-tetrayl tetrakis(3,4-dihydroxy-5-((3,4,5-trihydroxybenzoyl)oxy)benzoate) |
|---|---|
| IUPAC Name | (2S,3R,4S,5R,6R)-6-(((3,4-dihydroxy-5-((3,4,5-trihydroxybenzoyl)oxy)benzoyl)oxy)methyl)tetrahydro-2H-pyran-2,3,4,5-tetrayl tetrakis(3,4-dihydroxy-5-((3,4,5-trihydroxybenzoyl)oxy)benzoate) |
| Molecular Formula | C76H52O46 |
| Molecular Weight | 1701.21 |
| SMILES | O([C@H]1[C@@H]([C@H](O[C@H]([C@@H]1OC(C1C=C(C(=C(C=1)OC(C1C=C(C(=C(C=1)O)O)O)=O)O)O)=O)OC(C1C=C(C(=C(C=1)OC(C1C=C(C(=C(C=1)O)O)O)=O)O)O)=O)COC(C1C=C(C(=C(C=1)OC(C1C=C(C(=C(C=1)O)O)O)=O)O)O)=O)OC(C1C=C(C(=C(C=1)OC(C1C=C(C(=C(C=1)O)O)O)=O)O)O)=O)C(C1C=C(C(=C(C=1)OC(C1C=C(C(=C(C=1)O)O)O)=O)O)O)=O |
| InChI Key | LRBQNJMCXXYXIU-PPKXGCFTSA-N |
| Synonym | Gallotannin | TANNIC ACID | CAS-1401-55-4 | CHEBI:81066 | HMS3295C21 | A901485 | Tox21_111422 | (2R,3R,4S,5R,6S)-4,5,6-tris({3,4-dihydroxy-5-[(3,4,5-trihydroxyphenyl)carbonyloxy]phenyl}carbonyloxy)-2-[({3,4-dihydroxy-5-[(3,4,5-trihydroxyphenyl)carbonyloxy |
| CAS No. | 5424-20-4 |
| PubChem CID | 16129778 |
Safety Data
- Pictogram
- Signal Word
- Warning
- Hazard Statement(s)
- H302-H315-H319-H335-H412
- Precautionary Statement(s)
- P261-P273-P305+P351+P338
Synthetic Route by SureRoute
2. ACLCOS530 Molecular Building Block Synthetic Route
(2S,3R,4S,5R,6R)-6-(((3,4,5-Tris(benzyloxy)benzoyl)oxy)methyl)tetrahydro-2H-pyran-2,3,4,5-tetrayl tetrakis(3,4,5-tris(benzyloxy)benzoate)
(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl 4-hydroxy-3,5-dimethoxybenzoate
(2S,3R,4S,5R,6R)-5-Hydroxy-6-(((3,4,5-trihydroxybenzoyl)oxy)methyl)tetrahydro-2H-pyran-2,3,4-triyl tris(3,4,5-trihydroxybenzoate)