input word = C00063734

Metabolite InformationStructural formula
Name Filiasparoside G
Formula C49H80O21
Mw 1004.51920962
CAS RN 1240503-86-9
C_ID C00063734
InChIKey GHRRIQUPTATRRA-LQJSCJBOSA-N
InChICode InChI=1S/C49H80O21/c1-20(16-62-45-41(60)37(56)36(55)31(15-50)68-45)5-8-29-21(2)33-30(67-29)14-26-24-7-6-22-13-23(9-11-48(22,3)25(24)10-12-49(26,33)4)66-47-42(61)38(57)43(70-46-40(59)35(54)28(52)18-64-46)32(69-47)19-65-44-39(58)34(53)27(51)17-63-44/h20,22-28,30-47,50-61H,5-19H2,1-4H3/t20-,22+,23-,24+,25-,26-,27-,28+,30-,31+,32+,33-,34-,35-,36+,37-,38+,39+,40+,41+,42+,43+,44-,45+,46-,47+,48-,49-/m0/s1
SMILES CC1=C(CCC(C)COC2OC(CO)C(O)C(O)C2O)OC2CC3C4CCC5CC(OC6OC(COC7OCC(O)C(O)C7O)C(OC7OCC(O)C(O)C7O)C(O)C6O)CCC5(C)C4CCC3(C)C12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsparagaceaeAsparagus filicinus Ref.
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