| Name |
Arvensoside D |
| Formula |
C48H78O18 |
| Mw |
942.51881569 |
| CAS RN |
58231-97-3 |
| C_ID |
C00055340
|
| InChIKey |
OGKRHYLZKFTGGO-RHFDSUMBSA-N |
| InChICode |
InChI=1S/C48H78O18/c1-43(2)14-16-48(42(59)60)17-15-46(6)22(23(48)18-43)8-9-28-45(5)12-11-29(44(3,4)27(45)10-13-47(28,46)7)64-41-38(66-40-36(58)34(56)31(53)25(20-50)62-40)37(32(54)26(21-51)63-41)65-39-35(57)33(55)30(52)24(19-49)61-39/h8,23-41,49-58H,9-21H2,1-7H3,(H,59,60)/t23-,24+,25+,26+,27-,28+,29-,30-,31+,32+,33-,34-,35+,36+,37-,38+,39-,40-,41-,45-,46+,47+,48-/m0/s1 |
| SMILES |
CC(CC[C@]1(C(O)=O)CC[C@]23C)(C[C@@]1([H])C2=CC[C@]4([H])[C@]5(CC[C@H](O[C@@]6([H])[C@H](O[C@@]7([H])[C@H](O)[C@@H](O)[C@H](O)[C@H](O7)CO)[C@@H](O[C@@]8([H])[C@H](O)[C@@H](O)[C@@H](O)[C@H](O8)CO)[C@H](O)[C@H](O6)CO)C(C)([C@]5([H])CC[C@]43C)C)C)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Calendula officinalis  | Ref. |
|
|
zoom in
| Organism | Calendula officinalis |
|---|
| Reference | Takemoto, T. et al., Annalen, 1965, 685, 237-246 (Mubenins) |
|---|
|
