input word = C00037137

Metabolite InformationStructural formula
Name Fernandoside
(+)-Fernandoside
Formula C36H44O16
Mw 732.26293536
CAS RN 366492-00-4
C_ID C00037137 ,
InChIKey LVQMXTVSQMYOHE-CODKZOAFNA-N
InChICode InChI=1S/C36H44O16/c1-45-22-9-16(6-7-21(22)38)35(44)50-15-26-30(40)32(42)33(43)36(52-26)51-14-20-19(13-37)8-17-10-25(48-4)31(41)34(49-5)28(17)27(20)18-11-23(46-2)29(39)24(12-18)47-3/h6-7,9-12,19-20,26-27,30,32-33,36-43H,8,13-15H2,1-5H3/t19-,20-,26+,27+,30+,32-,33+,36+/m0/s1
SMILES COc1cc(C(=O)OC[C@H]2O[C@@H](OC[C@H]3[C@H](CO)Cc4cc(OC)c(O)c(OC)c4[C@@H]3c3cc(OC)c(O)c(OC)c3)[C@H](O)[C@@H](O)[C@@H]2O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBignoniaceaeFernandoa adenophylla Ref.
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