input word = C00020248

Metabolite InformationStructural formula
Name 3,14Z-Implexin
Formula C31H44O8
Mw 544.30361838
CAS RN 79434-21-2
C_ID C00020248 ,
InChIKey YBXRHCLFEHVDJU-KYGREHJVNA-N
InChICode InChI=1S/C31H44O8/c1-10-16(5)14-21(32)37-28-24(31(9)15-36-31)23-20(13-4)25(33)27(39-30(35)18(7)12-3)22(23)19(8)26(28)38-29(34)17(6)11-2/h13-14,17-18,22-24,26-28H,8,10-12,15H2,1-7,9H3/b16-14-,20-13-/t17-,18-,22-,23+,24-,26-,27-,28+,31-/m1/s1
SMILES C=C1[C@@H]2[C@H](/C(=C/C)C(=O)[C@@H]2OC(=O)C(C)CC)[C@@H](C2(C)CO2)[C@H](OC(=O)/C=C(/C)CC)[C@@H]1OC(=O)C(C)CC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSenecio implexus Ref.
zoom in