input word = C00035653

Metabolite InformationStructural formula
Name Hoodigoside K
(-)-Hoodigoside K
Formula C45H70O18
Mw 898.45621543
CAS RN 946409-73-0
C_ID C00035653 ,
InChIKey YAPIWGCPLZLZGZ-GCQSQRCRNA-N
InChICode InChI=1S/C45H70O18/c1-8-20(2)40(54)62-31-16-27-26(45(55)14-12-25(21(3)47)44(31,45)6)10-9-23-15-24(11-13-43(23,27)5)59-32-17-28(56-7)39(22(4)58-32)63-42-38(53)36(51)34(49)30(61-42)19-57-41-37(52)35(50)33(48)29(18-46)60-41/h8-9,22,24-39,41-42,46,48-53,55H,10-19H2,1-7H3/b20-8+/t22-,24+,25-,26-,27+,28+,29-,30-,31-,32+,33+,34+,35+,36+,37-,38-,39-,41-,42+,43+,44+,45+/m1/s1
SMILES C/C=C(C)C(=O)O[C@@H]1C[C@H]2[C@@H](CC=C3C[C@@H](O[C@H]4C[C@H](OC)[C@H](O[C@@H]5O[C@H](CO[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](C)O4)CC[C@@]32C)[C@@]2(O)CC[C@H](C(C)=O)[C@@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeHoodia gordonii Ref.
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