input word = C00041348

Metabolite InformationStructural formula
Name Ansaspirolide
Formula C24H26O4
Mw 378.18310932
CAS RN 879496-44-3
C_ID C00041348 ,
InChIKey KKXDPTDDMLHVAK-RCPPVSICNA-N
InChICode InChI=1S/C24H26O4/c1-3-5-11-20-23-13-12-15(14-19(23)22(26)27-20)17(8-4-2)24(23)18-10-7-6-9-16(18)21(25)28-24/h6-7,9-11,14-15,17H,3-5,8,12-13H2,1-2H3/b20-11-/t15-,17+,23+,24-/m0/s1
SMILES [C@H]1([C@@H]2C=C3[C@@]([C@]41c1c(C(=O)O4)cccc1)(/C(=C/CCC)/OC3=O)CC2)CCC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeAngelica sinensis Ref.
zoom in



OrganismAngelica sinensis
ReferenceDeng,J.Nat.Prod.,69,(2006),536