
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 36001-47-5 |
| Catalog No. | 2A-0202785 |
| Chinese Name | vescalagin |
| Synonyms | (-)-talagin |
| Molecular Formula | C41H26O26 |
| Molecular Weight | 934.63 |
| Density | 2.034g/cm3 |
| PubChem ID | 147247 |
| SMILES | O=C1OCC2OC(=O)c3cc(O)c(O)c(O)c3-c3c(O)c(O)c(O)c4c3C(=O)OC(C2OC(=O)c2cc(O)c(O)c(O)c2-c2c1cc(O)c(O)c2O)C1OC(=O)c2c-4c(O)c(O)c(O)c2C1O |
| InChI | InChI=1S/C41H26O26/c42-8-1-5-12(24(48)21(8)45)13-6(2-9(43)22(46)25(13)49)39(60)65-34-11(4-63-37(5)58)64-38(59)7-3-10(44)23(47)26(50)14(7)15-18-16(28(52)32(56)27(15)51)17-19-20(30(54)33(57)29(17)53)31(55)35(66-41(19)62)36(34)67-40(18)61/h1-3,11,31,34-36,42-57H,4H2/t11?,31-,34-,35-,36?/m1/s1 |
| InChI Key | UDYKDZHZAKSYCO-JLQXGYSZSA-N |
| Transport Info | Product name: vescalagin |
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