| Name |
Paeonianin E |
| Formula |
C42H30O26 |
| Mw |
950.10253114 |
| CAS RN |
558460-55-2 |
| C_ID |
C00044999
, 
|
| InChIKey |
GTHKFYXPOPHMRR-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C42H30O26/c1-64-38(59)7-2-11(43)27(51)31(55)19(7)22-21-23-20(32(56)34(58)33(21)57)18-10(5-14(46)26(50)30(18)54)41(62)68-37(36(22)67-42(23)63)35-15(47)6-65-39(60)8-3-12(44)24(48)28(52)16(8)17-9(40(61)66-35)4-13(45)25(49)29(17)53/h2-5,15,22,35-37,43-58H,6H2,1H3/t15-,22+,35+,36+,37-/m0/s1 |
| SMILES |
c1(c(cc2c(c1O)c1c3C(=O)O[C@@H]([C@@H](OC2=O)[C@@H]2OC(=O)c4c(c(c(c(c4)O)O)O)c4c(C(=O)OC[C@@H]2O)cc(c(c4O)O)O)[C@@H](c3c(c(c1O)O)O)c1c(c(c(cc1C(=O)OC)O)O)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Paeoniaceae | Paeonia lactiflora  | Ref. |
|
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