input word = C00005974

Metabolite InformationStructural formula
Name Variabiloside F
Formula C36H36O18
Mw 756.19016435
CAS RN 115794-35-9
C_ID C00005974 ,
InChIKey HLWFQXZBFQLASS-XRUBHKOINA-N
InChICode InChI=1S/C36H36O18/c1-14-26(43)28(45)30(47)35(50-14)49-13-23-33(53-24(42)9-4-15-2-6-17(37)7-3-15)29(46)31(48)36(52-23)54-34-27(44)25-21(41)11-18(38)12-22(25)51-32(34)16-5-8-19(39)20(40)10-16/h2-12,14,23,26,28-31,33,35-41,43,45-48H,13H2,1H3/b9-4-/t14-,23+,26-,28-,29-,30+,31+,33-,35+,36-/m0/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)O[C@H]1[C@@H]([C@@H]([C@H]([C@H](O1)CO[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)C)O)O)O)OC(=O)/C=C\c1ccc(cc1)O)O)O)c1ccc(c(c1)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLonganiaceaeStrychnos variabilis Ref.
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