$360.00
| CAS No.: | 51803-68-0 |
| Molecular Formula | C₂₂H₂₀O₁₃ |
| Molecular Weight | 492.4g/mol |
| Purity | HPLC>98% |
| Chemical Family | Phenols |
| Weight |
|---|
IUPAC Name: 6-hydroxy-7,14-dimethoxy-13-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione
InChI: InChI=1S/C22H20O13/c1-30-16-8(24)3-6-11-12-7(21(29)34-18(11)16)4-9(17(31-2)19(12)35-20(6)28)32-22-15(27)14(26)13(25)10(5-23)33-22/h3-4,10,13-15,22-27H,5H2,1-2H3/t10-,13-,14+,15-,22-/m1/s1
InChIKey: PNYQFRZBMVRYFC-CGWYSGAGSA-N
Canonical SMILES: COC1=C(C=C2C3=C1OC(=O)C4=CC(=C(C(=C43)OC2=O)OC)OC5C(C(C(C(O5)CO)O)O)O)O
Isomeric SMILES: COC1=C(C=C2C3=C1OC(=O)C4=CC(=C(C(=C43)OC2=O)OC)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O
Synonyms: 51803-68-0; 3,3′-Di-O-Methylellagic Acid 4′-Glucoside; 3,8-Di-O-methylellagic acid 2-O-glucoside; 3,3′-Di-O-methylellagic acid-4′-O-; A-D-glucopyranoside; 6-hydroxy-7,14-dimethoxy-13-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione; CHEMBL4449086; DTXSID301346181; …
Botanical Source:
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