input word = C00044361

Metabolite InformationStructural formula
Name Trilobalicin
Formula C35H62O8
Mw 610.44446896
CAS RN 189747-98-6
C_ID C00044361 ,
InChIKey FTBUPRVFMAYNFL-MSZVEWAINA-N
InChICode InChI=1S/C35H62O8/c1-3-4-5-6-7-8-9-13-16-29(37)33-21-22-34(43-33)31(39)19-18-30(38)32-20-17-28(42-32)15-12-10-11-14-27(36)24-26-23-25(2)41-35(26)40/h23,25,27-34,36-39H,3-22,24H2,1-2H3/t25-,27-,28+,29+,30+,31+,32-,33+,34-/m1/s1
SMILES O1[C@@H](C=C(C1=O)C[C@H](O)CCCCC[C@H]1CC[C@@H](O1)[C@H](CC[C@H](O)[C@@H]1O[C@@H](CC1)[C@H](CCCCCCCCCC)O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAsimina triloba Ref.
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OrganismAsimina triloba
ReferenceZafra-Polo,Phytochem.,48,(1998),1087