| Name |
Gymnoside X |
| Formula |
C51H64O24 |
| Mw |
1060.37875298 |
| CAS RN |
898827-01-5 |
| C_ID |
C00030444
, 
|
| InChIKey |
KBFPWMHZCPGQRU-KHNXCBCYNA-N |
| InChICode |
InChI=1S/C51H64O24/c1-4-26(2)51(50(65)68-24-30-12-17-32(18-13-30)70-48-44(63)42(61)39(58)34(22-53)72-48,20-37(56)67-23-29-10-15-31(16-11-29)69-47-43(62)41(60)38(57)33(21-52)71-47)75-49-45(64)46(40(59)35(73-49)25-66-27(3)54)74-36(55)19-14-28-8-6-5-7-9-28/h5-19,26,33-35,38-49,52-53,57-64H,4,20-25H2,1-3H3/b19-14-/t26-,33+,34+,35+,38+,39+,40+,41-,42-,43+,44+,45+,46-,47+,48+,49-,51-/m0/s1 |
| SMILES |
CCC(C)[C@](CC(=O)OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)(O[C@@H]1O[C@H](COC(C)=O)[C@@H](O)[C@H](OC(=O)/C=Cc2ccccc2)[C@H]1O)C(=O)OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Orchidaceae | Gymnadenia conopsea R.BR. | Ref. |
|
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