| Name |
Watterose J
(-)-Watterose J |
| Formula |
C51H60O29 |
| Mw |
1136.32202596 |
| CAS RN |
291767-06-1 |
| C_ID |
C00046973
, 
|
| InChIKey |
MISABXSHYLHQBU-DTXHWJRPNA-N |
| InChICode |
InChI=1S/C51H60O29/c1-22(54)70-19-32-37(62)41(66)43(68)49(74-32)76-44-38(63)33(20-71-34(59)13-9-23-7-11-26(55)28(57)15-23)75-50(45(44)77-48-42(67)40(65)36(61)30(17-52)73-48)80-51(21-72-35(60)14-10-24-8-12-27(56)29(58)16-24)46(39(64)31(18-53)79-51)78-47(69)25-5-3-2-4-6-25/h2-16,30-33,36-46,48-50,52-53,55-58,61-68H,17-21H2,1H3/b13-9+,14-10+/t30-,31-,32-,33-,36-,37-,38-,39-,40+,41+,42-,43-,44+,45-,46+,48+,49+,50-,51+/m1/s1 |
| SMILES |
[C@@H]1([C@@H]([C@H]([C@@H](O[C@@H]1COC(=O)C)O[C@@H]1[C@@H](O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)[C@H](O[C@@H]([C@H]1O)COC(=O)/C=C/c1ccc(c(c1)O)O)O[C@]1([C@H]([C@@H]([C@H](O1)CO)O)OC(=O)c1ccccc1)COC(=O)/C=C/c1ccc(c(c1)O)O)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Polygalaceae | Polygala wattersii | Ref. |
|
|
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