input word = C00040432

Metabolite InformationStructural formula
Name Tabularisin F
(+)-Tabularisin F
Formula C37H44O17
Mw 760.25784998
CAS RN 958220-12-7
C_ID C00040432 ,
InChIKey XDCGIERGEWDMKB-ODEJXHFTNA-N
InChICode InChI=1S/C37H44O17/c1-15(2)25(42)51-28-35(45)27(49-17(4)39)29(5)13-34(35,44)30(6,19(29)11-20(40)46-8)36-23-21(41)32-14-33(32,37(28,36)54-31(7,52-23)53-36)24(48-16(3)38)26(43)50-22(32)18-9-10-47-12-18/h9-10,12,15,19,21-24,27-28,41,44-45H,11,13-14H2,1-8H3/t19-,21-,22-,23+,24-,27-,28+,29+,30+,31+,32-,33+,34+,35+,36-,37-/m0/s1
SMILES COC(=O)C[C@H]1[C@@]2(C)C[C@]3(O)[C@@](O)([C@@H](OC(=O)C(C)C)[C@]45O[C@]6(C)OC([C@H](O)[C@]78C[C@@]74[C@@H](OC(C)=O)C(=O)O[C@H]8c4ccoc4)[C@]5(O6)[C@]13C)[C@H]2OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeChukrasia tabularis var. velutina Ref.
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