input word = C00034042

Metabolite InformationStructural formula
Name Lyconoside IV
(-)-Lyconoside IV
Formula C46H74O19
Mw 930.48243018
CAS RN 1032750-75-6
C_ID C00034042 ,
InChIKey FBIGXMMOWQOKET-KOTSJJQZNA-N
InChICode InChI=1S/C46H74O19/c1-18-9-12-46(65-40(18)57-6)19(2)30-26(64-46)14-25-23-8-7-21-13-22(10-11-44(21,4)24(23)15-29(49)45(25,30)5)59-43-39(63-41-36(55)34(53)31(50)20(3)58-41)38(33(52)28(17-48)61-43)62-42-37(56)35(54)32(51)27(16-47)60-42/h7,18-20,22-43,47-56H,8-17H2,1-6H3/t18-,19+,20+,22+,23-,24+,25+,26+,27-,28-,29-,30+,31+,32-,33+,34-,35+,36-,37-,38+,39-,40-,41+,42+,43-,44+,45-,46+/m1/s1
SMILES CO[C@@H]1O[C@]2(CC[C@H]1C)O[C@H]1C[C@H]3[C@@H]4CC=C5C[C@@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O[C@@H]6O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)CC[C@]5(C)[C@H]4C[C@@H](O)[C@]3(C)[C@H]1[C@@H]2C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeSolanum lycocarpum Ref.
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