| Name |
Watterose B
(-)-Watterose B |
| Formula |
C53H62O29 |
| Mw |
1162.33767602 |
| CAS RN |
292138-63-7 |
| C_ID |
C00046965
, 
|
| InChIKey |
NPNKPEBRQTXZSZ-DIRMHCKWNA-N |
| InChICode |
InChI=1S/C53H62O29/c1-24(56)71-21-34-39(64)42(67)44(69)51(75-34)78-46-45(77-37(62)17-11-26-8-13-29(58)14-9-26)35(22-72-25(2)57)76-52(47(46)79-50-43(68)41(66)38(63)32(19-54)74-50)82-53(23-73-36(61)16-12-27-10-15-30(59)31(60)18-27)48(40(65)33(20-55)81-53)80-49(70)28-6-4-3-5-7-28/h3-18,32-35,38-48,50-52,54-55,58-60,63-69H,19-23H2,1-2H3/b16-12+,17-11+/t32-,33-,34-,35-,38-,39-,40-,41+,42+,43-,44-,45-,46+,47-,48+,50+,51+,52-,53+/m1/s1 |
| SMILES |
CC(=O)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O[C@]3(COC(=O)/C=C/c4ccc(O)c(O)c4)O[C@H](CO)[C@@H](O)[C@@H]3OC(=O)c3ccccc3)O[C@H](COC(C)=O)[C@H]2OC(=O)/C=C/c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Polygalaceae | Polygala wattersii | Ref. |
|
|
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