| Name |
Ceparoside B |
| Formula |
C44H72O18 |
| Mw |
888.4718655 |
| CAS RN |
516454-90-3 |
| C_ID |
C00054799
|
| InChIKey |
HWYCRLFVQVFKPD-FWSUTEMSSA-N |
| InChICode |
InChI=1S/C44H72O18/c1-18(16-56-39-36(53)35(52)33(50)28(15-45)59-39)8-11-44(55)19(2)30-27(62-44)14-25-23-7-6-21-12-22(46)13-29(43(21,5)24(23)9-10-42(25,30)4)60-41-38(32(49)26(47)17-57-41)61-40-37(54)34(51)31(48)20(3)58-40/h6,18-20,22-41,45-55H,7-17H2,1-5H3/t18-,19+,20+,22-,23-,24+,25+,26+,27+,28-,29-,30+,31+,32+,33-,34-,35+,36-,37-,38-,39-,40+,41+,42+,43+,44-/m1/s1 |
| SMILES |
C[C@H](CC[C@@]1(O)O[C@H]2C[C@H]3[C@@H]4CC=C5C[C@@H](O)C[C@@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2[C@@H]1C)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Alliaceae | Allium cepa  | Ref. |
|
|
zoom in
| Organism | Allium cepa |
|---|
| Reference | Kravets, S.D. et al., Chem. Nat. Compd. (Engl. Transl.), 1986, 22, 174-181 (Alliofuroside A) |
|---|
|
