| Name |
Rotundifolioside F
(-)-Rotundifolioside F |
| Formula |
C48H78O17 |
| Mw |
926.52390107 |
| CAS RN |
626253-92-7 |
| C_ID |
C00031204
, 
|
| InChIKey |
QMTJQYFIEZNPTM-PWRNRNSHNA-N |
| InChICode |
InChI=1S/C48H78O17/c1-20-21(2)39-47(16-24(20)50)19-59-48(39)15-11-27-44(7)13-12-29(43(5,6)26(44)10-14-45(27,8)46(48,9)17-28(47)51)63-41-37(34(56)31(53)23(4)61-41)65-42-38(35(57)32(54)25(18-49)62-42)64-40-36(58)33(55)30(52)22(3)60-40/h11,15,20-42,49-58H,10,12-14,16-19H2,1-9H3/t20-,21-,22-,23+,24-,25+,26-,27+,28+,29-,30+,31-,32+,33-,34-,35-,36+,37+,38+,39+,40-,41-,42-,44-,45+,46-,47-,48?/m0/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)(C[C@@H]([C@H]([C@@H]1C)C)O)CO3)C)C)C)(C)C)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]1O[C@H]([C@H]([C@@H]([C@H]1O)O)O)C)O)O)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Apiaceae | Bupleurum rotundifolium  | Ref. |
|
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