| Name |
Brodiosaponin C
(-)-Brodiosaponin C |
| Formula |
C52H82O25 |
| Mw |
1106.51451817 |
| CAS RN |
190781-46-5 |
| C_ID |
C00050279
, 
|
| InChIKey |
FXYWXZPTWDOQFS-YRNDOQFYNA-N |
| InChICode |
InChI=1S/C52H82O25/c1-17-15-68-52(45(66)41(17)74-47-39(64)36(61)33(58)19(3)69-47)18(2)32-28(77-52)12-25-24-9-8-22-10-23(55)11-31(50(22,6)26(24)13-30(57)51(25,32)7)73-49-44(76-48-40(65)37(62)42(20(4)70-48)71-21(5)54)43(35(60)29(14-53)72-49)75-46-38(63)34(59)27(56)16-67-46/h8,17-20,23-49,53,55-66H,9-16H2,1-7H3/t17-,18+,19-,20+,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+,48+,49+,50+,51-,52+/m1/s1 |
| SMILES |
C1[C@@H](CC2=CC[C@H]3[C@@H]([C@]2([C@@H]1O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)C)OC(=O)C)O)O)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O)O)CO)C)C[C@H]([C@]1([C@H]3C[C@H]2[C@@H]1[C@@H]([C@@]1(O2)OC[C@H]([C@@H]([C@@H]1O)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)C)O)O)O)C)C)C)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Themidaceae | Brodiaea californica | Ref. |
|
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