| Name |
Bellisoside F |
| Formula |
C77H122O35 |
| Mw |
1606.77666567 |
| CAS RN |
850497-12-0 |
| C_ID |
C00029806
, 
|
| InChIKey |
PEAPGHHXLGKHCJ-FMLFEDIONA-N |
| InChICode |
InChI=1S/C77H122O35/c1-31(79)22-47(84)99-32(2)23-48(85)100-33(3)24-49(86)101-34(4)25-50(87)107-60-37(7)105-70(64(57(60)94)110-69-63(106-39(9)80)58(95)61(38(8)104-69)108-66-59(96)62(43(82)29-98-66)109-67-55(92)53(90)51(88)35(5)102-67)112-71(97)77-21-20-72(10,11)26-41(77)40-16-17-45-73(12)27-42(81)65(111-68-56(93)54(91)52(89)36(6)103-68)74(13,30-78)44(73)18-19-75(45,14)76(40,15)28-46(77)83/h16,31-38,41-46,51-70,78-79,81-83,88-96H,17-30H2,1-15H3/t31-,32-,33-,34-,35-,36-,37+,38-,41-,42-,43+,44+,45+,46+,51-,52-,53+,54+,55+,56+,57-,58+,59+,60-,61-,62-,63+,64+,65-,66-,67-,68-,69-,70-,73+,74-,75+,76+,77+/m0/s1 |
| SMILES |
CC(=O)O[C@H]1[C@H](O[C@H]2[C@H](OC(=O)[C@]34CCC(C)(C)C[C@H]3C3=CC[C@@H]5[C@@]6(C)C[C@H](O)[C@H](O[C@@H]7O[C@@H](C)[C@H](O)[C@@H](O)[C@H]7O)[C@@](C)(CO)[C@@H]6CC[C@@]5(C)[C@]3(C)C[C@H]4O)O[C@H](C)[C@H](OC(=O)C[C@H](C)OC(=O)C[C@H](C)OC(=O)C[C@H](C)OC(=O)C[C@H](C)O)[C@@H]2O)O[C@@H](C)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H]2O)[C@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Bellis perennis  | Ref. |
|
|
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