| Name |
Jionoside B1 |
| Formula |
C37H50O20 |
| Mw |
814.28954404 |
| CAS RN |
120406-37-3 |
| C_ID |
C00002754
, 
|
| InChIKey |
FXFHFOSEURHWMO-CXZZYKNKNA-N |
| InChICode |
InChI=1S/C37H50O20/c1-16-26(42)28(44)31(47)37(53-16)57-34-32(48)36(51-11-10-18-5-8-21(49-2)20(40)12-18)55-24(15-52-35-30(46)29(45)27(43)23(14-38)54-35)33(34)56-25(41)9-6-17-4-7-19(39)22(13-17)50-3/h4-9,12-13,16,23-24,26-40,42-48H,10-11,14-15H2,1-3H3/b9-6+/t16-,23+,24-,26-,27-,28-,29-,30+,31+,32-,33+,34-,35+,36+,37-/m0/s1 |
| SMILES |
[C@@H]1([C@H]([C@@H]([C@@H](O[C@H]1CO[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)OCCc1ccc(c(c1)O)OC)O)O[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)C)O)O)O)OC(=O)/C=C/c1cc(c(cc1)O)OC |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Scrophulariaceae | Rehmannia glutinosa  | Ref. |
|
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