| Name |
Dioscoreside E |
| Formula |
C52H84O23 |
| Mw |
1076.54033899 |
| CAS RN |
435321-73-6 |
| C_ID |
C00030139
, 
|
| InChIKey |
WSWNKHNNDHPGMZ-PYUQJVKMNA-N |
| InChICode |
InChI=1S/C52H84O23/c1-20(19-67-47-41(63)39(61)35(57)30(16-53)71-47)13-29(66-6)44-21(2)33-28(70-44)15-27-25-8-7-23-14-24(9-11-51(23,4)26(25)10-12-52(27,33)5)69-50-46(75-48-42(64)38(60)34(56)22(3)68-48)45(37(59)32(18-55)73-50)74-49-43(65)40(62)36(58)31(17-54)72-49/h7,20,22,24-43,45-50,53-65H,8-19H2,1-6H3/t20-,22+,24+,25-,26+,27+,28+,29+,30-,31-,32-,33+,34+,35-,36-,37-,38-,39+,40+,41-,42-,43-,45+,46-,47-,48+,49+,50-,51+,52+/m1/s1 |
| SMILES |
C1[C@@H](CC2=CC[C@@H]3[C@@H]([C@]2(C1)C)CC[C@]1([C@H]3C[C@H]2[C@@H]1C(=C([C@H](C[C@H](CO[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)C)OC)O2)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)C)O)O)O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)O)CO |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Dioscoreaceae | Dioscorea futschauensis  | Ref. |
|
|
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