input word = C00033951

Metabolite InformationStructural formula
Name (-)-Immunoside
Immunoside
Formula C45H74O16
Mw 870.49768632
CAS RN 602306-86-5
C_ID C00033951 ,
InChIKey KFYOFJUUTSALEH-BIFDYHRWNA-N
InChICode InChI=1S/C45H74O16/c1-19-9-14-45(54-18-19)20(2)30-28(61-45)16-27-25-8-7-23-15-24(10-12-43(23,5)26(25)11-13-44(27,30)6)57-42-39(60-41-36(52)34(50)32(48)22(4)56-41)37(53)38(29(17-46)58-42)59-40-35(51)33(49)31(47)21(3)55-40/h19-42,46-53H,7-18H2,1-6H3/t19-,20-,21-,22-,23+,24-,25+,26-,27-,28-,29+,30-,31-,32-,33+,34+,35+,36+,37-,38-,39+,40-,41-,42+,43-,44-,45+/m0/s1
SMILES C[C@H]1CC[C@@]2(OC1)O[C@H]1C[C@H]3[C@@H]4CC[C@@H]5C[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O[C@@H]7O[C@@H](C)[C@H](O)[C@@H](O)[C@H]7O)[C@H](O)[C@H]6O[C@@H]6O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsparagaceaeAsparagus officinalis Ref.
PlantaeAsparagaceaeAsparagus racemosus Ref.
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