input word = C00037147

Metabolite InformationStructural formula
Name Fesumtuorin C
Formula C32H30O11
Mw 590.1788118
CAS RN 267009-29-0
C_ID C00037147 ,
InChIKey IIVLKXAGPYYIDA-ZBXWWWQKNA-N
InChICode InChI=1S/C32H30O11/c1-31(2,36)24(16-40-30-27-18(9-11-38-27)13-17-5-7-26(35)42-28(17)30)43-32(3,4)23(33)15-39-29-19-6-8-25(34)41-22(19)14-21-20(29)10-12-37-21/h5-14,23-24,33,36H,15-16H2,1-4H3/t23-,24-/m1/s1
SMILES c12c(cc3c(c1OC[C@H](C(C)(O)C)OC([C@@H](COc1c4c(cc5c1ccc(=O)o5)occ4)O)(C)C)oc(=O)cc3)cco2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeFerula sumbul Ref.
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OrganismFerula sumbul
ReferenceZhou,Phytochem.,53,(2000),689