| Name |
Rotundifolioside G
(+)-Rotundifolioside G |
| Formula |
C47H76O18 |
| Mw |
928.50316563 |
| CAS RN |
626253-90-5 |
| C_ID |
C00031205
, 
|
| InChIKey |
CAJPMUBOHPLZJI-NDJBZGHLNA-N |
| InChICode |
InChI=1S/C47H76O18/c1-21-7-13-46-20-60-47(38(46)22(21)2)14-9-27-42(3)11-10-29(43(4,19-50)26(42)8-12-44(27,5)45(47,6)15-28(46)52)63-40-36(33(56)31(54)24(16-48)61-40)65-41-37(34(57)32(55)25(17-49)62-41)64-39-35(58)30(53)23(51)18-59-39/h9,14,21-41,48-58H,7-8,10-13,15-20H2,1-6H3/t21-,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?,47-/m1/s1 |
| SMILES |
C1[C@@H]([C@@]([C@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@]2([C@@]3(C=C1)[C@H]1[C@@]([C@@H](C2)O)(CC[C@H]([C@@H]1C)C)CO3)C)C)C)(C)CO)O[C@@H]1O[C@@H]([C@@H]([C@@H]([C@H]1O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O)O)O)CO |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Apiaceae | Bupleurum rotundifolium  | Ref. |
|
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