| Name |
Solanigroside E
(-)-Solanigroside E |
| Formula |
C55H88O28 |
| Mw |
1196.54621223 |
| CAS RN |
905914-29-6 |
| C_ID |
C00041870
, 
|
| InChIKey |
ZLDXDSLOWPJHII-AAOLXZMDNA-N |
| InChICode |
InChI=1S/C55H88O28/c1-18-12-29(60)55(83-47(18)71)19(2)30-43(82-55)36(65)31-23-7-6-21-13-22(8-10-53(21,4)24(23)9-11-54(30,31)5)75-51-45(80-50-40(69)37(66)32(61)20(3)74-50)41(70)42(28(15-57)77-51)78-52-46(81-49-39(68)34(63)26(59)17-73-49)44(35(64)27(14-56)76-52)79-48-38(67)33(62)25(58)16-72-48/h18-46,48-52,56-70H,6-17H2,1-5H3/t18-,19+,20+,21+,22+,23-,24+,25-,26+,27-,28-,29+,30+,31-,32+,33+,34+,35-,36-,37-,38-,39-,40-,41+,42+,43-,44+,45-,46-,48+,49+,50+,51-,52+,53+,54+,55-/m1/s1 |
| SMILES |
C[C@@H]1C[C@H](O)[C@@]2(OC1=O)O[C@H]1[C@H](O)[C@H]3[C@@H]4CC[C@H]5C[C@@H](O[C@@H]6O[C@H](CO)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O[C@@H]8OC[C@@H](O)[C@H](O)[C@H]8O)[C@H]7O[C@@H]7OC[C@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O[C@@H]6O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Solanaceae | Solanum nigrum  | Ref. |
|
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