input word = C00034665

Metabolite InformationStructural formula
Name Russelioside F
(-)-Russelioside F
Formula C50H74O17
Mw 946.49260094
CAS RN 942061-18-9
C_ID C00034665 ,
InChIKey LPVZJRLEFPWLNQ-KGMJSYBQNA-N
InChICode InChI=1S/C50H74O17/c1-25(60-28(4)52)32-17-19-50(57)33-15-14-30-20-31(16-18-48(30,5)34(33)21-38(49(32,50)6)65-46(56)29-12-10-9-11-13-29)63-39-22-35(58-7)44(26(2)61-39)66-40-23-36(59-8)45(27(3)62-40)67-47-43(55)42(54)41(53)37(24-51)64-47/h9-14,25-27,31-45,47,51,53-55,57H,15-24H2,1-8H3/t25-,26-,27-,31+,32-,33-,34+,35+,36+,37-,38-,39+,40+,41+,42+,43-,44-,45-,47+,48+,49+,50+/m1/s1
SMILES C1[C@@H](CC2=CC[C@@H]3[C@@H]([C@]2(C1)C)C[C@H]([C@]1([C@@]3(CC[C@@H]1[C@H](OC(=O)C)C)O)C)OC(=O)c1ccccc1)O[C@@H]1O[C@@H]([C@H]([C@H](C1)OC)O[C@H]1C[C@@H]([C@@H]([C@H](O1)C)O[C@@H]1O[C@@H]([C@@H]([C@@H]([C@H]1O)O)O)CO)OC)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeCaralluma russeliana Ref.
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